EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes

hexyl amine

Supplier Sponsors

CAS Number: 111-26-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:203-851-8
Nikkaji Web:J45.009J
Beilstein Number:1731298
CoE Number:10478
XlogP3:2.10 (est)
Molecular Weight:101.19255000
Formula:C6 H15 N
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavoring agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
JECFA Food Flavoring:1588 hexylamine
DG SANTE Food Flavourings:11.016 hexylamine
FEMA Number:4243 hexylamine
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):111-26-2 ; HEXYLAMINE
Physical Properties:
Appearance:colorless to yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.76100 to 0.76700 @ 25.00 °C.
Pounds per Gallon - (est).: 6.332 to 6.382
Refractive Index:1.41500 to 1.42100 @ 20.00 °C.
Melting Point: -24.00 to -22.00 °C. @ 760.00 mm Hg
Boiling Point: 130.00 to 133.00 °C. @ 760.00 mm Hg
Vapor Pressure:9.119000 mmHg @ 25.00 °C. (est)
Flash Point: 48.00 °F. TCC ( 8.89 °C. )
logP (o/w): 2.060
Soluble in:
 propylene glycol
 water, 2.057e+004 mg/L @ 25 °C (est)
 water, 1.20E+04 mg/L @ 25 °C (exp)
Organoleptic Properties:
Odor Type: fishy
ammoniacal musty fishy
Odor Description:at 0.10 % in propylene glycol. ammoniacal musty fishy
Odor and/or flavor descriptions from others (if found).
Cosmetic Information:
None found
EMD Millipore
For experimental / research use only.
Penta International
Santa Cruz Biotechnology
For experimental / research use only.
Sigma-Aldrich: Aldrich
For experimental / research use only.
Hexylamine 99%
For experimental / research use only.
Hexylamine >99.0%(GC)(T)
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xn - Harmful.
R 10 - Flammable.
R 21/22 - Harmful in contact with skin and if swallowed.
R 35 - Causes severe burns.
S 02 - Keep out of the reach of children.
S 16 - Keep away from sources of ignition - No Smoking.
S 20/21 - When using do not eat, drink or smoke.
S 23 - Do not breath vapour.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
S 45 - In case of accident or if you feel unwell seek medical advice immediately.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50 670 mg/kg
AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

Dermal Toxicity:
skin-rabbit LD50 420 ul/kg
AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

Inhalation Toxicity:
inhalation-rat LCLo 500 ppm/4H
AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

Safety in Use Information:
flavoring agents
Recommendation for hexyl amine usage levels up to:
 not for fragrance use.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.024 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.007 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 340 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 22
Click here to view publication 22
 average usual ppmaverage maximum ppm
baked goods: 2.0000010.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: 0.200001.00000
cheese: 0.400002.00000
chewing gum: --
condiments / relishes: 0.100000.50000
confectionery froastings: 1.000005.00000
egg products: --
fats / oils: 0.100000.50000
fish products: 0.200001.00000
frozen dairy: 0.400002.00000
fruit ices: 0.400002.00000
gelatins / puddings: --
granulated sugar: --
gravies: 0.100000.50000
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.200001.00000
milk products: 0.400002.00000
nut products: --
other grains: 0.200001.00000
poultry: 0.200001.00000
processed fruits: 0.400002.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 0.100000.50000
snack foods: 1.000005.00000
soft candy: --
soups: 0.100000.50000
sugar substitutes: --
sweet sauces: --
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 0.400002.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.100000.50000
Edible ices, including sherbet and sorbet (03.0): 0.400002.00000
Processed fruit (04.1): 0.400002.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 1.000005.00000
Chewing gum (05.3): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 0.200001.00000
Bakery wares (07.0): 2.0000010.00000
Meat and meat products, including poultry and game (08.0): 0.200001.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 0.200001.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.100000.50000
Foodstuffs intended for particular nutritional uses (13.0): 0.200001.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): --
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 1.000005.00000
Ready-to-eat savouries (15.0): 1.000005.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 0.200001.00000
Safety References:
European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Flavouring Group Evaluation 86, (FGE.86)[1] - Consideration of aliphatic and aromatic amines and amides evaluated by JECFA (65th meeting) - Scientific Opinion of the Panel on Food Additives - Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 86, Revision 1 (FGE.86Rev1): Consideration of aliphatic and aromatic amines and amides evaluated by JECFA (65th meeting)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 86, Revision 2 (FGE.86Rev2): Consideration of aliphatic and arylalkyl amines and amides evaluated by JECFA (65th meeting)
View page or View pdf

EPI System: View
NIOSH International Chemical Safety Cards:search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):111-26-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :8102
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
EPA/NOAA CAMEO:hazardous materials
RTECS:MQ4540000 for cas# 111-26-2
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:111-26-2
Pubchem (cid):8102
Pubchem (sid):134975012
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
KEGG (GenomeNet):C08306
HMDB (The Human Metabolome Database):HMDB32323
Export Tariff Code:2921.19.6090
Potential Blenders and core components note
For Odor
fish thiol
For Flavor
No flavor group found for these
amyl amine
amyl amine
butyl amine
butyl amine
butyl amine
ethyl amine
methyl butyl amine
pentylidene isopentyl amine
phenethyl amine
propionyl pyrroline 1% in vegatable oil triglyceride
propyl amine
propyl amine
trimethyl benzyl amine
tripropyl amine
methyl piperidine
dimethyl thiazole
trimethyl amine
fish thiol
Potential Uses:
Occurrence (nature, food, other):note
 not found in nature
1-hexyl amine
mono-N-hexyl amine
N-hexyl amine


Info:aliphatic and aromatic amines and amides
PubMed:Automated derivatization and fluorimetric determination of biogenic amines in milk by zone fluidics coupled to liquid chromatography.
PubMed:Control of glycopolymer nanoparticle morphology by a one-pot, double modification procedure using thiolactones.
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PubMed:Cytotoxicity of Diimine Palladium (II) Complexes of Alkyldithiocarbamate Derivatives on Human Lung, Ovary and Liver Cells.
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PubMed:Transferable force field for equilibrium and transport properties in linear, branched, and bifunctional amines I. Primary amines.
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PubMed:Determination of picropodophyllin and its isomer podophyllotoxin in human serum samples with electrospray ionization of hexylamine adducts by liquid chromatography-tandem mass spectrometry.
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PubMed:Simultaneous spectrophotometric analysis of aliphatic amines utilizing thermochromism of charge-transfer complexes with tetrabromophenolphthalein ethyl ester.
PubMed:Development of a headspace gas chromatography method to determine residual aliphatic amines in oligonucleotides.
PubMed:Stability of different formulations and ion pairs of hypericin.
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PubMed:Identification and quantification of (polymeric) hindered-amine light stabilizers in polymers using pyrolysis-gas chromatography-mass spectrometry and liquid chromatography-ultraviolet absorbance detection-evaporative light scattering detection.
PubMed:Inhibition of nucleoside transport proteins by C8-alkylamine-substituted purines.
PubMed:Determination of aliphatic amines in mineral flotation liquors and reagents by high-performance liquid chromatography after derivatization with 4-chloro-7-nitrobenzofurazan.
PubMed:On the mechanism of drug-induced acceleration of phospholipid translocation in the human erythrocyte membrane.
PubMed:Synthesis of Nepsilon-protected-L-lysine and gamma-benzyl-L-glutamate N-carboxyanhydrides (NCA) by carbamoylation and nitrosation.
PubMed:Retention behavior of C1-C6 aliphatic monoamines on anion-exchange and polymethacrylate resins with heptylamine as eluent.
PubMed:Separation and conductimetric detection of C1-C7 aliphatic monocarboxylic acids and C1-C7 aliphatic monoamines on unfunctionized polymethacrylate resin columns.
PubMed:Application of polymethacrylate resin as stationary phase in liquid chromatography with UV detection for C1-C7 aliphatic monocarboxylic acids and C1-C7 aliphatic monoamines.
PubMed:Vacancy ion-exclusion/adsorption chromatography of aliphatic amines on a polymethacrylate-based weakly basic anion-exchange column.
PubMed:Sensitive determination of aliphatic amines in water by high-performance liquid chromatography with chemiluminescence detection.
PubMed:A synthetic strategy for novel nonsymmetrical bola amphiphiles based on carbohydrates.
PubMed:Nonaqueous capillary electrophoresis-mass spectrometry of synthetic polymers.
PubMed:Extraction of heavy metals by amines adsorbed onto silica gel.
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PubMed:Comparison of high-performance and thin-layer chromatographic methods for the assay of lidocaine.
PubMed:Determination of aliphatic and alicyclic amines in water by gas and liquid chromatography after derivatization by chloroformates.
PubMed:Comparison of kinetic properties between plant and fungal amine oxidases.
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PubMed:Photophysical study of the Schiff bases of 5'-deoxypyridoxal and n-hexylamine in cationic micelles.
PubMed:Treatment of malignant hypercalcaemia with aminohexane bisphosphonate (neridronate).
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PubMed:Liquid secondary ion mass spectrometry analysis of permethylated, n-hexylamine derivatized oligosaccharides. Application to baculovirus expressed mouse interleukin-3.
PubMed:Determination of psychotropic phenylalkylamine derivatives in biological matrices by high-performance liquid chromatography with photodiode-array detection.
PubMed:Determination of (S)-(-)-cathinone and its metabolites (R,S)-(-)-norephedrine and (R,R)-(-)-norpseudoephedrine in urine by high-performance liquid chromatography with photodiode-array detection.
PubMed:Ligand specificity of human plasminogen kringle 4.
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PubMed:Biological microemulsions: Part III--The formation characteristics and transport properties of saffola-aerosol OT-hexylamine-water system.
PubMed:Ligand interactions with the kringle 5 domain of plasminogen. A study by 1H NMR spectroscopy.
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PubMed:Hyperthermia enhances the in vitro activity of 1-hexylcarbamoyl-5-fluorouracil compared to that of 5-fluorouracil.
PubMed:Deamination of aliphatic amines of different chain lengths by rat liver monoamine oxidase A and B.
PubMed:The specific interaction between fibrin(ogen) and hyaluronan: possible consequences in haemostasis, inflammation and wound healing.
PubMed:Comparative carcinogenesis by nitrosomethylalkylamines in Syrian hamsters.
PubMed:Evidence for a functional role for histidine in lysyl oxidase catalysis.
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PubMed:The use of fluorescent probes as markers for sheep lymphocyte subpopulations.
PubMed:Synthesis, configuration, and evaluation of two conformationally restrained analogues of phencyclidine.
PubMed:Diphosphonates and phosphate homoeostasis in man.
PubMed:Aminohexane diphosphonate in the treatment of Paget's disease of bone.
PubMed:Beneficial effects of aminohexane diphosphonate in patients with Paget's disease of bone resistant to sodium etidronate.
PubMed:Increased activity of monoamine oxidase by epoxy resin hardeners.
PubMed:Tresyl activation of a hydroxyalkyl ligand for coupling to a hydrazide gel: stable immobilization of T-2 toxin for affinity purification of T-2 antibody.
PubMed:Micromolar Ca2+ requiring protease from human platelets: purification, partial characterization and effect on the cytoskeletal proteins.
PubMed:Comparative effects of intravenous diphosphonates on calcium and skeletal metabolism in man.
PubMed:Study of the hydrolysis and ionization constants of Schiff base from pyridoxal 5'-phosphate and n-hexylamine in partially aqueous solvents. An application to phosphorylase b.
PubMed:Preparation and use of synthetic cell culture surfaces. A new reagent for the covalent immobilization of proteins and glycoproteins on a nonionic inert matrix.
PubMed:Biochemical characterization and biologic activities of 82- and 86-kDa tumor antigens isolated from a methylcholanthrene-induced sarcoma, CII-7.
PubMed:Application of retention indices based on the alkylarylketone scale to the separation of the local anaesthetic drugs by high-performance liquid chromatography.
PubMed:Voltage-dependent aminoglycoside blockade of the sarcoplasmic reticulum K+ channel.
PubMed:Synthesis of nitrogen-13 labeled alkylamines via amination of organoboranes.
PubMed:6-Oxygenation of 3-oxo-4-ene-steroids in high yields after 3-imine-formation.
PubMed:High-performance liquid chromatography systems for the separation of local anaesthetic drugs with applicability to the analysis of illicit cocaine samples.
PubMed:Role of a low-pH environment in adenovirus enhancement of the toxicity of a Pseudomonas exotoxin-epidermal growth factor conjugate.
PubMed:Physical model approach in the study of the transport of alkyl amines across a silicone rubber membrane in a two-chamber diffusion cell.
PubMed:Preparation of alkylamine and 125I-radiolabeled derivatives of hyaluronic acid uniquely modified at the reducing end.
PubMed:Trichosporon adeninovorans sp. nov., a yeast species utilizing adenine, xanthine, uric acid, putrescine and primary n-alkylamines as the sole source of carbon, nitrogen and energy.
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PubMed:Effects of KCl-EGTA solution on the isolated Mytilus smooth muscle: a method for denervation.
PubMed:Factors effecting cell attachment, spreading, and growth on derivatized microcarriers: II introduction of hydrophobic elements.
PubMed:Effect of aliphatic monoamines on motor activity of mice: no direct interaction with dopaminergic D2 receptor.
PubMed:Increase in the phosphotransferase specific activity of purified Rous sarcoma virus pp60v-src protein after incubation with ATP plus Mg2+.
PubMed:[Effects of oxygen and drugs on monoamine oxidase in the dog liver].
PubMed:Induction of tumors of the esophagus in rats by nitrosomethylalkylamines.
PubMed:Homogeneous substrate-labeled fluorescent immunoassay for human serum albumin.
PubMed:Purification and biochemical properties of tumor-associated transplantation antigens from methylcholanthrene-induced murine sarcomas.
PubMed:Interaction of aliphatic amines with glycogen phosphorylase.
PubMed:Purification of RNA associated and unassociated forms of 1,4-alpha-glucan branching enzyme from rat liver.
PubMed:A sensitive assay for mutagenic activity of N-nitrosamines and its use for detection of modulators of the mutagenicity.
PubMed:Homogeneous substrate-labeled fluorescent immunoassay for IgG in human serum.
PubMed:Mode of inactivation of putrescine oxidase by 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide or metal ions.
PubMed:T4 RNA ligase as a nucleic acid synthesis and modification reagent.
PubMed:Further study on the effect of mersalyl, an organic mercurial, on relaxing response of a molluscan smooth muscle to monoamines.
PubMed:Quantitative relationships between phosphorylation, electron flow, and internal hydrogen ion concentrations in spinach chloroplasts.
PubMed:[On the mode of action of heptaminol (author's transl)].
PubMed:Intestinal transport of weak electrolytes. Evidence in favor of a three-compartment system.
PubMed:Synthesis and activity of N-n-butyl-n-hexylamine hydrochloride (BHA).
PubMed:Mechanism of the sympathomimetic action of cyclohexylamine and hexylamine: release of catecholamines from nerve endings.
PubMed:The displacement of calcium ions from phospholipid monolayers by pharmacologically active and other organic bases.
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