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

hexyl decanoate
decanoic acid, hexyl ester

Supplier Sponsors

Name:hexyl decanoate
CAS Number: 10448-26-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:233-932-3
FDA UNII:D2D42X538B
Nikkaji Web:J115.102I
MDL:MFCD01050431
XlogP3-AA:6.50 (est)
Molecular Weight:256.42944000
Formula:C16 H32 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance 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:1874 hexyl decanoate
FEMA Number:4342 hexyl decanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):10448-26-7 ; HEXYL DECANOATE
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.85700 to 0.86300 @ 20.00 °C.
Pounds per Gallon - (est).: 7.139 to 7.189
Refractive Index:1.43200 to 1.43800 @ 20.00 °C.
Boiling Point: 303.00 to 305.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 283.00 °F. TCC ( 139.44 °C. )
logP (o/w): 6.899 (est)
Soluble in:
 alcohol
 water, 0.06006 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl decanoate
amyl decanoate
isoamyl decanoate
benzyl decanoate
butyl decanoate
isobutyl decanoate
citronellyl decanoate
decyl decanoate
ethyl 2-acetyl decanoate
ethyl decanoate
furfuryl decanoate
heptyl decanoate
(Z)-3-hexen-1-yl decanoate
2-methyl butyl decanoate
methyl decanoate
nonyl decanoate
octyl decanoate
phenethyl decanoate
propyl decanoate
isopropyl decanoate
sulfuryl decanoate
 
Organoleptic Properties:
Odor Description:fresh green
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Hexyl Decanoate
Naturamole
hexyl decanoate 98% natural EU
Penta International
HEXYL DECANOATE
 
Safety Information:
 
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
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for hexyl decanoate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
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: 23
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 0.300001.50000
beverages(alcoholic): 0.500002.50000
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: 0.500002.50000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 1.000005.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: 0.500002.50000
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):10448-26-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :82635
National Institute of Allergy and Infectious Diseases:Data
hexyl decanoate
Chemidplus:0010448267
 
References:
 hexyl decanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):82635
Pubchem (sid):135042193
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
HMDB (The Human Metabolome Database):HMDB32324
FooDB:FDB009574
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 guava fruit
Search Trop Picture
 
Synonyms:
 decanoic acid hexyl ester
 decanoic acid, hexyl ester
 decanoic acid, hexylester
 hexyl caprate
 

Articles:

PubMed:Carcinostatic effects of diverse ascorbate derivatives in comparison with aliphatic chain moiety structures: Promotion by combined hyperthermia and reduced cytotoxicity to normal cells.
PubMed:Synthesis of alkyl esters by cutinase in miniemulsion and organic solvent media.
PubMed:Signals and cues in the recruitment behavior of stingless bees (Meliponini).
PubMed:The effect of increased yeast alcohol acetyltransferase and esterase activity on the flavour profiles of wine and distillates.
PubMed:Hexyl decanoate, the first trail pheromone compound identified in a stingless bee, Trigona recursa.
PubMed:Effect of increased yeast alcohol acetyltransferase activity on flavor profiles of wine and distillates.
PubMed:Effect of cytochrome b5 on fatty acid omega- and (omega-1)-hydroxylation catalyzed by partially purified cytochrome P-450 from rabbit kidney cortex microsomes.
 
Notes:
Used as a food additive [EAFUS]
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