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

amyl octanoate
amyl caprylate

Sponsors

Name:pentyl octanoate
CAS Number: 638-25-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-328-0
FDA UNII:1KWP15429R
Nikkaji Web:J95.693G
MDL:MFCD00048919
CoE Number:393
XlogP3-AA:4.90 (est)
Molecular Weight:214.34862000
Formula:C13 H26 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
PubMed:Search
NCBI:Search
JECFA Food Flavoring:174 N-amyl octanoate
FLAVIS Number:09.112 (Old)
DG SANTE Food Flavourings:09.112 pentyl octanoate
FEMA Number:2079 N-amyl octanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: AMYL OCTANOATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: Yes
Specific Gravity:0.86200 to 0.86500 @ 20.00 °C.
Pounds per Gallon - (est).: 7.181 to 7.206
Refractive Index:1.42700 to 1.42900 @ 20.00 °C.
Melting Point: -34.00 to -35.00 °C. @ 760.00 mm Hg
Boiling Point: 260.00 to 261.00 °C. @ 760.00 mm Hg
Boiling Point: 124.00 to 216.00 °C. @ 12.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.014000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 5.280
Soluble in:
 alcohol
 fixed oils
 water, 1.132 mg/L @ 25 °C (est)
Insoluble in:
 water
 glycerin
Similar Items:note
allyl octanoate
isoamyl octanoate
benzyl octanoate
butyl octanoate
isobutyl octanoate
citronellyl octanoate
ortho-cresyl octanoate
para-cresyl octanoate
decyl octanoate
ethyl 4-methyl octanoate
ethyl octanoate
furfuryl octanoate
geranyl octanoate
heptyl octanoate
(E)-2-hexen-1-yl octanoate
(Z)-3-hexen-1-yl octanoate
hexyl octanoate
linalyl octanoate
2-methyl butyl octanoate
methyl octanoate
nonyl octanoate
octyl octanoate
phenethyl octanoate
propyl octanoate
isopropyl octanoate
sulfuryl octanoate
 
Organoleptic Properties:
Odor Type: earthy
Odor Strength:medium
orris sweet winey cognac elderflower fatty
Odor Description:at 100.00 %. orris sweet winey cognac elderflower fatty
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Alfrebro
n-AMYL(PENTYL) OCTANOATE
Odor: Fruit, Floral, Coconut
BOC Sciences
For experimental / research use only.
Amyl Octanoate
Grau Aromatics
AMYL-CAPRYLATE (n-AMYL-OCTANOATE) FCC
NI, Kosher
Indukern F&F
AMYL CAPRYLATE
Odor: FLORAL, SWEET, WINE
Inoue Perfumery
AMYL OCTANOATE
Lluch Essence
AMYL CAPRYLATE
Odor: FRUITY, CITRIC, FATTY
Parchem
amyl octanoate
Penta International
AMYL CAPRYLATE FCC, Kosher
Sigma-Aldrich
N-Amyl octanoate, ≥98%, FG
Odor: wine-like; sweet
Certified Food Grade Products
Silverline Chemicals
Amyl Caprylate
SRS Aromatics
AMYL CAPRYLATE FCC
Odor: Orris, Sweet, Winey, Elderflower
Synerzine
n-amyl caprylate
TCI AMERICA
For experimental / research use only.
Amyl n-Octanoate >98.0%(GC)
Vigon International
Amyl Caprylate FCC (Mixed Isomers 35/65)
 
Safety Information:
Preferred SDS: View
 
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 amyl octanoate usage levels up to:
  6.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 3.40 (μg/capita/day)
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: 3
 average usual ppmaverage maximum ppm
baked goods: -3.50000
beverages(nonalcoholic): -5.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -3.50000
fruit ices: -3.50000
gelatins / puddings: -2.10000
granulated sugar: --
gravies: --
hard candy: -6.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
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:
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 2, Revision 1 (FGE.02) : Branched- and straight-chain aliphatic saturated primary alcohols and related esters of primary alcohols and straight-chain carboxylic acids and one straight-chain aldehyde from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):638-25-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :61185
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
pentyl octanoate
Chemidplus:0000638255
 
References:
 pentyl octanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:638-25-5
Pubchem (cid):61185
Pubchem (sid):135018449
 
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 Everything Added to Food in the United States (EAFUS):View
KEGG (GenomeNet):C04780
HMDB (The Human Metabolome Database):HMDB36217
FooDB:FDB015075
Export Tariff Code:2915.90.0000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
adoxal (Givaudan)
FL/FR
nonanal (aldehyde C-9)
FL/FR
TMH aldehyde
FR
amber
formoxymethyl isolongifolene
FR
balsamic
cinnamyl butyrate
FL/FR
opoponax oil (balsamodendron kafal)
FL/FR
opoponax resinoid (balsamodendron kafal)
FR
terpinyl cinnamate
FL/FR
caramellic
diethyl malate
FL/FR
citrus
bitter
orange peel oil brazil
FL/FR
10-
undecen-1-ol
FL/FR
ethereal
iso
amyl acetoacetate
FL/FR
iso
butyl alcohol
FL/FR
decyl propionate
FL/FR
ethyl formate
FL/FR
methyl acetate
FL/FR
fatty
allyl octanoate
FL/FR
butyl undecylenate
FL/FR
ethyl undecylenate
FL/FR
(Z)-2-
nonenal
CS
fermented
iso
butyl decanoate
FL/FR
hexanal diethyl acetal
FL/FR
methyl decanoate
FL/FR
3-
methyl-1-pentanol
FL/FR
floral
cyclohexyl ethyl alcohol
FL/FR
dihydro-alpha-ionone
FL/FR
dimethyl anthranilate
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl hexanoate
FL/FR
hexyl 2-furoate
FL/FR
(E)-beta-
ionone
FL/FR
alpha-
ionone
FL/FR
alpha-
irone
FL/FR
methyl citronellate
FL/FR
beta-iso
methyl ionone
FL/FR
N-
methyl ionone
FR
alpha-iso
methyl ionone (50% min.)
FL/FR
3-
nonanon-1-yl acetate
FL/FR
orris pyridine 25% IPM
FR
phenethyl hexanoate
FL/FR
fruity
allyl heptanoate
FL/FR
amyl decanoate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
butyl acetoacetate
FL/FR
butyl anthranilate
FL/FR
butyl hexanoate
FL/FR
decyl butyrate
FL/FR
diethyl laevo-tartrate
FL/FR
diethyl sebacate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl 3,5,5-trimethyl hexanoate
FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
farnesyl acetone
FL/FR
geranyl acetoacetate
FL/FR
4-
heptanone
FL/FR
3-
hexanone
FL/FR
(Z)-3-
hexen-1-yl 2-methyl-2-pentenoate
FR
methyl (E,Z)-2,4-decadienoate
FL/FR
methyl heptanoate
FL/FR
methyl nonanoate
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl butyrate
FL/FR
2-
pentanone
FL/FR
propyl heptanoate
FL/FR
sorbyl butyrate
FL/FR
2-
undecanone
FL/FR
green
benzaldehyde dimethyl acetal
FL/FR
green
cognac oil
FL/FR
ethyl (E)-4-decenoate
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
hexyl phenyl acetate
FL/FR
(E)-2-
octen-1-yl acetate
FL/FR
herbal
acetyl tributyl citrate
FL/FR
iso
amyl tiglate
FL/FR
anthemis nobilis flower oil roman
FL/FR
white
cognac oil
FL/FR
2-
cyclohexyl cyclohexanone
FR
ethyl chrysanthemate
FR
nonisyl acetate
FR
phenethyl senecioate
FL/FR
honey
methyl hydrocinnamate
FL/FR
melon
(Z)-6-
nonenal
FL/FR
orris
eugenyl formate
FL/FR
iso
eugenyl formate
FL/FR
2(1)-
orris butanal
FL/FR
orris capronate
FL/FR
para-iso
propyl acetophenone
FL/FR
powdery
dimethyl ionone
FR
alpha-
methyl ionone
FL/FR
(E)-alpha-
methyl ionone (74-80%)
FL/FR
roasted
2-
methyl-1-butanol
FL/FR
soapy
ethyl undecanoate
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
allyl nonanoate
FL/FR
iso
amyl laurate
FL/FR
3-
decanone
FL/FR
(Z)-4-
decen-1-ol
FL/FR
ethyl decanoate
FL/FR
ethyl laurate
FL/FR
ethyl myristate
FL/FR
ethyl nonanoate
FL/FR
ethyl octanoate
FL/FR
ethyl palmitate
FL/FR
methyl butyl phenyl acetate
FL/FR
methyl undecanoate
FR
myristyl alcohol
FL/FR
(E)-2-
octen-1-yl butyrate
FL/FR
octyl 2-methyl butyrate
FL/FR
phenethyl octanoate
FL/FR
phytyl acetate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
winey
butyl angelate
FL/FR
2-
hexanol
FL/FR
woody
diethyl dimethyl-2-cyclohexenone
FR
dihydro-beta-ionone
FL/FR
orris hexanone
FR
woody nonane (ethoxy)
FR
For Flavor
No flavor group found for these
acetyl tributyl citrate
FL/FR
amyl decanoate
FL/FR
iso
amyl tiglate
FL/FR
2-
amyl-5 or 6-keto-1,4-dioxane
FL
butyl angelate
FL/FR
iso
butyl decanoate
FL/FR
iso
butyraldehyde propylene glycol acetal
FL
costus root absolute
FL
costus root resinoid
FL
3-
decanone
FL/FR
(Z)-4-
decen-1-ol
FL/FR
decyl propionate
FL/FR
diethyl laevo-tartrate
FL/FR
diethyl malate
FL/FR
ethyl aconitate
FL
iso
eugenyl formate
FL/FR
eugenyl formate
FL/FR
farnesyl acetone
FL/FR
geranyl acetoacetate
FL/FR
hexanal diethyl acetal
FL/FR
2-
hexanol
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
methyl hydrocinnamate
FL/FR
beta-iso
methyl ionone
FL/FR
2-
methyl-1-butanol
FL/FR
myristyl alcohol
FL/FR
(E)-2-
octen-1-yl butyrate
FL/FR
2(1)-
orris butanal
FL/FR
phenethyl senecioate
FL/FR
phytyl acetate
FL/FR
sorbyl propionate
FL
(E)-2-
tridecen-1-yl acetate
FL/FR
10-
undecen-1-ol
FL/FR
aldehydic
aldehydic
nonanal (aldehyde C-9)
FL/FR
balsamic
opoponax oil (balsamodendron kafal)
FL/FR
berry
dihydro-alpha-ionone
FL/FR
ethereal
iso
butyl alcohol
FL/FR
ethyl formate
FL/FR
methyl acetate
FL/FR
fatty
allyl octanoate
FL/FR
iso
amyl laurate
FL/FR
ethyl (E)-4-decenoate
FL/FR
ethyl undecylenate
FL/FR
methyl decanoate
FL/FR
floral
(E)-
geranyl acetone
FL/FR
alpha-
ionone
FL/FR
methyl citronellate
FL/FR
alpha-iso
methyl ionone (50% min.)
FL/FR
(E)-alpha-
methyl ionone (74-80%)
FL/FR
fruity
allyl heptanoate
FL/FR
iso
amyl acetoacetate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
butyl acetoacetate
FL/FR
butyl anthranilate
FL/FR
butyl hexanoate
FL/FR
decyl butyrate
FL/FR
diethyl sebacate
FL/FR
dimethyl anthranilate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
geranyl hexanoate
FL/FR
4-
heptanone
FL/FR
3-
hexanone
FL/FR
hexyl phenyl acetate
FL/FR
methyl heptanoate
FL/FR
alpha-
methyl ionone
FL/FR
3-
nonanon-1-yl acetate
FL/FR
bitter
orange peel oil brazil
FL/FR
2-
pentanone
FL/FR
phenethyl octanoate
FL/FR
sorbyl butyrate
FL/FR
terpinyl cinnamate
FL/FR
fusel
green
cognac oil
FL/FR
white
cognac oil
FL/FR
green
benzaldehyde dimethyl acetal
FL/FR
cyclohexyl ethyl alcohol
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
hexyl 2-furoate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
methyl 2-undecynoate
FL
4-
methyl-2-pentenal
FL
(Z)-6-
nonenal
FL/FR
(E)-2-
octen-1-yl acetate
FL/FR
herbal
anthemis nobilis flower oil roman
FL/FR
leafy
methyl butyl phenyl acetate
FL/FR
musty
propionaldehyde
FL
orris
costus root oil
FL
orris capronate
FL/FR
spicy
para-iso
propyl acetophenone
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
adoxal (Givaudan)
FL/FR
allyl nonanoate
FL/FR
butyl undecylenate
FL/FR
ethyl decanoate
FL/FR
ethyl laurate
FL/FR
ethyl myristate
FL/FR
ethyl nonanoate
FL/FR
ethyl octanoate
FL/FR
ethyl palmitate
FL/FR
ethyl undecanoate
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl 2-methyl butyrate
FL/FR
octyl butyrate
FL/FR
phenethyl hexanoate
FL/FR
propyl heptanoate
FL/FR
2-
undecanone
FL/FR
whiskey
3-
methyl-1-pentanol
FL/FR
winey
cinnamyl butyrate
FL/FR
methyl nonanoate
FL/FR
woody
dihydro-beta-ionone
FL/FR
(E)-beta-
ionone
FL/FR
alpha-
irone
FL/FR
 
Potential Uses:
FRchocolate
FRorris
 wine
 
Occurrence (nature, food, other):note
 quince fruit
Search Trop Picture
 
Synonyms:
 amyl caprylate
 amyl caprylate FCC
 amyl N-octanoate
N-amyl octanoate
 amyl octoate
 amyl octylate
 amyl-caprylate (n-amyl-octanoate) FCC
N-amyl(pentyl) octanoate
N-caprylic acid n-amyl ester
 octanoic acid pentyl ester
 octanoic acid, pentyl ester
 pentyl octanoate
 pentyl octylate
 
 
Notes:
Flavouring agent
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