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

hexyl nonanoate
nonanoic acid, hexyl ester

Sponsors

Name:hexyl nonanoate
CAS Number: 6561-39-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:229-488-5
FDA UNII:R71E988O4U
Nikkaji Web:J115.094D
XlogP3-AA:6.00 (est)
Molecular Weight:242.40250000
Formula:C15 H30 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:1873 hexyl nonanoate
FEMA Number:4339 hexyl nonanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: HEXYL NONANOATE
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.85800 to 0.86300 @ 20.00 °C.
Pounds per Gallon - (est).: 7.148 to 7.189
Refractive Index:1.43100 to 1.43600 @ 20.00 °C.
Boiling Point: 291.00 to 292.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.002000 mm/Hg @ 25.00 °C. (est)
Flash Point: 266.00 °F. TCC ( 130.00 °C. )
logP (o/w): 6.390 (est)
Soluble in:
 alcohol
 water, 0.1577 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl nonanoate
amyl nonanoate
isoamyl nonanoate
benzyl nonanoate
butyl nonanoate
isobutyl nonanoate
ethyl nonanoate
geranyl nonanoate
heptyl nonanoate
methyl nonanoate
nonyl nonanoate
octyl nonanoate
phenethyl nonanoate
propyl nonanoate
isopropyl nonanoate
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
brandy green vegetable fruity
Odor Description:at 100.00 %. brandy green vegetable fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Axsyn
For experimental / research use only.
Nonanoic acid, hexylester
BOC Sciences
For experimental / research use only.
Hexyl nonan-1-oate
Inoue Perfumery
HEXYL NONANOATE
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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 nonanoate usage levels up to:
  12.0000 % 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: 0.4000010.00000
beverages(nonalcoholic): 10.00000100.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: 10.00000200.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: 0.4000010.00000
fish products: --
frozen dairy: 0.200002.00000
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.4000010.00000
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:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :81045
National Institute of Allergy and Infectious Diseases:Data
hexyl nonanoate
Chemidplus:0006561393
 
References:
 hexyl nonanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):81045
Pubchem (sid):135037979
 
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
HMDB (The Human Metabolome Database):HMDB32328
FooDB:FDB009581
ChemSpider:View
 
Potential Blenders and core components note
For Odor
animal
methyl (E)-2-octenoate
FL/FR
balsamic
iso
amyl benzoate
FL/FR
fir carboxylate
FR
hexyl cinnamate
FR
citrus
(R)-
citronellyl nitrile
FR
citrus specialty
FR
2-
heptanol
FL/FR
bitter
orange peel oil brazil
FL/FR
ethereal
cyclohexyl formate
FL/FR
decyl propionate
FL/FR
ethyl formate
FL/FR
2-
methyl valeraldehyde
FL/FR
fatty
3-
decen-2-one
FL/FR
hexyl pivalate
FR
methyl (E)-2-hexenoate
FL/FR
methyl 2-hexenoate
FL/FR
fermented
iso
butyl decanoate
FL/FR
hexanal diethyl acetal
FL/FR
3-
methyl-1-pentanol
FL/FR
floral
alpha-
amyl cinnamaldehyde diethyl acetal
FR
boronia absolute
FL/FR
cassis cyclohexene
FR
gamma-
damascone
FR
dihydrocarvyl acetate
FL/FR
(±)-2,3-
dihydrofarnesol
FL/FR
6,8-
dimethyl-2-nonanol
FR
(E)-
geranyl acetone
FL/FR
geranyl formate
FL/FR
geranyl isobutyrate
FL/FR
hexyl lactate
FL/FR
jasmin cyclopentanol
FR
(Z)-
jasmone
FL/FR
(2-
methoxy-1-methyl propyl) benzene
FR
para-
methyl benzyl acetate
FL/FR
methyl citronellate
FL/FR
papaya isobutyrate
FL/FR
tilia cordata flower oil CO2 extract
FR
fruity
allyl amyl glycolate
FR
allyl butyrate
FL/FR
3-
allyl oxy-1,4-dimethyl bicyclo(3.2.1)octane
FR
iso
amyl butyrate
FL/FR
amyl lactate
FL/FR
butyl acetoacetate
FL/FR
iso
butyl acetoacetate
FL/FR
3-
butyl bicyclo[3.2.1]-6-octen-2-one
FR
butyl formate
FL/FR
iso
butyl octanoate
FL/FR
iso
butyl propionate
FL/FR
cherry pentenoate
FL/FR
cinnamyl hexanoate
FL/FR
2-
cyclopentyl cyclopentanone
FL/FR
1,4-
dibutyl-6,8-dioxabicyclo(3.2.1)octane
FR
diethyl malonate
FL/FR
dimethyl succinate
FL/FR
ethyl (E)-3-hexenoate
FL/FR
ethyl 2-cyclohexyl propionate
FR
ethyl 2-hexenoate
FL/FR
ethyl 2-octenoate
FL/FR
ethyl acetoacetate
FL/FR
ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate
FL/FR
endo-
ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate
FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
ethyl levulinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
(E,E)-
ethyl sorbate
FL/FR
fig crotonate
FR
fruity butanate
FR
geranyl ethyl ether
FL/FR
geranyl isovalerate
FL/FR
4-
heptanone
FL/FR
2-
heptyl butyrate
FL/FR
heptyl isobutyrate
FL/FR
heptyl valerate
FR
2-
hexen-1-ol
FL/FR
(E)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl anthranilate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl acetate
FL/FR
hexyl isovalerate
FL/FR
hexyl propionate
FL/FR
hexyl valerate
FL/FR
methyl heptanoate
FL/FR
methyl octadienoate
FL/FR
methyl valerate
FL/FR
3-
methyl-2-butenal
FL/FR
nerolidyl isobutyrate
FR
(Z)-6-
nonen-1-al dimethyl acetal
FR
octen-1-yl cyclopentanone
FL/FR
octyl butyrate
FL/FR
2-
pentyl furan
FL/FR
3-
phenyl propyl hexanoate
FL/FR
4-
phenyl-2-butyl acetate
FL/FR
pineapple pentenoate
FL/FR
prenyl hexanoate
FL/FR
rhubarb undecane
FR
sorbyl butyrate
FL/FR
(E,E)-
sorbyl butyrate
FL/FR
tetrahydrofurfuryl butyrate
FL/FR
tropical specialty
FR
tropical thiazole
FL/FR
tropical trithiane
FL/FR
green
acetaldehyde benzyl 2-methoxyethyl acetal
FL/FR
actinidia chinensis fruit extract
FL/FR
actinidia chinensis fruit water
FR
actinidia chinensis seed extract
CS
allyl phenethyl ether
FR
2-iso
butyl pyrazine
FL/FR
cucumber essence
FL/FR
black
currant bud absolute replacer
FL/FR
alpha-
decalactone
FL/FR
ethyl (E)-2-hexenoate
FL/FR
ethyl (E)-4-decenoate
FL/FR
galbanum specialty
FR
geranium thiazole
FL/FR
green dioxolane
FR
green note propionate
FL/FR
herbal cyclohexane
FR
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(E)-2-
hexenal propylene glycol acetal
FL/FR
4-
hexenol
FL/FR
3-
hexenyl acetate
FL/FR
(Z)-3-
hexenyl methyl ether
FR
hexyl isobutyrate
FL/FR
hexyl octanoate
FL/FR
manzanate (Givaudan)
FL/FR
methyl (E)-3-hexenoate
FL/FR
neogall
FR
2-
octen-1-ol
FL/FR
1-
penten-3-ol
FL/FR
(E)-2-
pentenal
FL/FR
iso
propyl decanoate
FL/FR
propylene acetal
FL/FR
sorbyl isobutyrate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
1-[(3aS,7aR)-3a,4,7,7a-
tetrahydro-1H-inden-6-yl]ethanone
FR
thiogeraniol
FL/FR
violet dienyne
FR
herbal
anthemis nobilis flower oil roman
FL/FR
3-
butylidene phthalide
FL/FR
6-
methoxy-2,6-dimethyl octanal
FR
(1S,5R)-
myrtenyl acetate
FL/FR
2-
pentyl acetate
FL/FR
tagete oil india
FL/FR
tricyclodecyl acetate
FR
viridiflorol
FL/FR
minty
carvyl acetate
FL/FR
iso
propyl tiglate
FL/FR
soapy
ethyl undecanoate
FL/FR
spicy
cinnamyl propionate
FL/FR
2,5-
dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate + 1,4-dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate
FR
sulfurous
4-
methyl 4-mercaptopentan-2-one 1% solution
FL/FR
vegetable
endo-1,2,3,3-
tetramethyl bicyclo(2.2.1)heptan-2-ol
FR
waxy
ethyl decanoate
FL/FR
ethyl octanoate
FL/FR
(E)-
methyl geranate
FL/FR
octyl 2-methyl butyrate
FL/FR
propyl decanoate
FL/FR
winey
heptyl decanoate
FL/FR
methyl 3-acetoxyoctanoate
FL/FR
woody
verdoxan
FR
For Flavor
No flavor group found for these
acetaldehyde benzyl 2-methoxyethyl acetal
FL/FR
actinidia chinensis fruit juice
FL
allyl levulinate
FL
allyl tiglate
FL
amyl lactate
FL/FR
butyl acetoacetate
FL/FR
iso
butyl decanoate
FL/FR
butyl formate
FL/FR
iso
butyl octanoate
FL/FR
2-iso
butyl pyrazine
FL/FR
cinnamyl hexanoate
FL/FR
2-
cyclopentyl cyclopentanone
FL/FR
alpha-
decalactone
FL/FR
decyl propionate
FL/FR
2,5-
diethyl-4-propyl thiazole
FL
(±)-2,3-
dihydrofarnesol
FL/FR
ethyl 2-(methyl thio) acetate
FL
ethyl 2-hexenoate
FL/FR
ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate
FL/FR
geranyl ethyl ether
FL/FR
2-
heptyl butyrate
FL/FR
heptyl decanoate
FL/FR
hexanal diethyl acetal
FL/FR
2-
hexenal
FL
(E)-3-
hexenal
FL
2-
hexenal diethyl acetal
FL
(E)-2-
hexenal propylene glycol acetal
FL/FR
3-
hexenyl acetate
FL/FR
hexyl (E)-2-hexenoate
FL
hexyl propionate
FL/FR
hexyl valerate
FL/FR
methyl (E)-2-hexenoate
FL/FR
methyl 2-hexenoate
FL/FR
methyl 3-acetoxyoctanoate
FL/FR
methyl 3-hydroxybutyrate
FL
4-
methyl 4-mercaptopentan-2-one 1% solution
FL/FR
(E)-
methyl geranate
FL/FR
methyl octadienoate
FL/FR
4-(
methyl thio) butanol
FL
2-
methyl-3-heptanone
FL
2-
methyl-6-propoxypyrazine
FL
(E,E)-3,5-
octadien-2-one
FL
3-
octyl butyrate
FL
4-
phenyl-2-butyl acetate
FL/FR
prenyl hexanoate
FL/FR
propyl decanoate
FL/FR
iso
propyl decanoate
FL/FR
2-iso
propyl pyridine
FL
2-iso
propyl-3-(methyl thio) pyrazine
FL
propylene acetal
FL/FR
(E,E)-
sorbyl butyrate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
viridiflorol
FL/FR
sorbyl isobutyrate
FL/FR
alliaceous
alliaceous
3-
tetrahydrothiophenone
FL
tropical thiazole
FL/FR
berry
heptyl isobutyrate
FL/FR
celery
3-
butylidene phthalide
FL/FR
cooling
manzanate (Givaudan)
FL/FR
creamy
2,4-
heptadienal
FL
dairy
2-
pentyl acetate
FL/FR
earthy
1-
hexen-3-yl acetate
FL
estery
ethyl acetoacetate
FL/FR
ethereal
ethyl formate
FL/FR
fatty
ethyl (E)-4-decenoate
FL/FR
2-
octen-1-ol
FL/FR
floral
cinnamyl propionate
FL/FR
dihydrocarvyl acetate
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl isobutyrate
FL/FR
(Z)-3-
hexen-1-yl anthranilate
FL/FR
methyl citronellate
FL/FR
fruity
iso
amyl benzoate
FL/FR
boronia absolute
FL/FR
iso
butyl acetoacetate
FL/FR
iso
butyl propionate
FL/FR
cherry pentenoate
FL/FR
black
currant bud absolute replacer
FL/FR
diethyl malonate
FL/FR
dimethyl succinate
FL/FR
ethyl (E)-2-hexenoate
FL/FR
ethyl (E)-3-hexenoate
FL/FR
ethyl 2-octenoate
FL/FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
ethyl levulinate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
(E,E)-
ethyl sorbate
FL/FR
2-
heptanol
FL/FR
4-
heptanone
FL/FR
2-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(E)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl acetate
FL/FR
hexyl lactate
FL/FR
kiwi distillates
FL
methyl (E)-2-octenoate
FL/FR
para-
methyl benzyl acetate
FL/FR
methyl heptanoate
FL/FR
methyl valerate
FL/FR
3-
methyl-2-butenal
FL/FR
(Z)-3-
nonen-1-yl acetate
FL
(Z)-5-
octen-1-yl acetate
FL
octen-1-yl cyclopentanone
FL/FR
bitter
orange peel oil brazil
FL/FR
3-
phenyl propyl hexanoate
FL/FR
pineapple pentenoate
FL/FR
sorbyl butyrate
FL/FR
tetrahydrofurfuryl butyrate
FL/FR
tropical trithiane
FL/FR
green
actinidia chinensis fruit extract
FL/FR
allyl butyrate
FL/FR
cucumber essence
FL/FR
cyclohexyl formate
FL/FR
3-
decen-2-one
FL/FR
dihydroxyacetophenone (mixed isomers)
FL
geranium thiazole
FL/FR
geranyl formate
FL/FR
geranyl isovalerate
FL/FR
green note propionate
FL/FR
(E,E)-2,4-
hexadienal
FL
(Z)-4-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl isobutyrate
FL/FR
hexyl isovalerate
FL/FR
hexyl octanoate
FL/FR
methyl (E)-3-hexenoate
FL/FR
methyl 2-undecynoate
FL
3-(5-
methyl-2-furyl) butanal
FL
4-
methyl-2-pentenal
FL
papaya isobutyrate
FL/FR
1-
penten-3-ol
FL/FR
(E)-2-
pentenal
FL/FR
2-
pentyl furan
FL/FR
2-
propyl pyrazine
FL
iso
propyl tiglate
FL/FR
propylene glycol acetone ketal
FL
herbal
anthemis nobilis flower oil roman
FL/FR
tagete oil india
FL/FR
metallic
4-
hexenol
FL/FR
minty
carvyl acetate
FL/FR
thiogeraniol
FL/FR
pungent
acetaldehyde
FL
sour
3-
methyl valeric acid
FL
sulfurous
methyl benzyl disulfide
FL
vegetable
2-
methyl valeraldehyde
FL/FR
waxy
iso
amyl butyrate
FL/FR
ethyl decanoate
FL/FR
ethyl octanoate
FL/FR
ethyl undecanoate
FL/FR
octyl 2-methyl butyrate
FL/FR
octyl butyrate
FL/FR
whiskey
3-
methyl-1-pentanol
FL/FR
woody
(Z)-
jasmone
FL/FR
(1S,5R)-
myrtenyl acetate
FL/FR
 
Potential Uses:
FLbrandy
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 hexyl nonan-1-oate
 hexyl pelargonate
 nonanoic acid hexyl ester
 nonanoic acid, hexyl ester
 

Articles:

PubMed:Characterization of aroma compounds of Chinese famous liquors by gas chromatography-mass spectrometry and flash GC electronic-nose.
PubMed:Dehalococcoides mccartyi gen. nov., sp. nov., obligately organohalide-respiring anaerobic bacteria relevant to halogen cycling and bioremediation, belong to a novel bacterial class, Dehalococcoidia classis nov., order Dehalococcoidales ord. nov. and family Dehalococcoidaceae fam. nov., within the phylum Chloroflexi.
PubMed:Chain length dependency of fatty acid and carbamate binding to serum albumin.
 
Notes:
Used as a food additive [EAFUS]
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