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

nonyl octanoate
nonyl caprylate

Supplier Sponsors

Name:nonyl octanoate
CAS Number: 7786-48-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:232-099-3
FDA UNII:X6F9O759XX
Nikkaji Web:J115.089H
CoE Number:396
XlogP3-AA:7.10 (est)
Molecular Weight:270.45638000
Formula:C17 H34 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:178 nonyl octanoate
FLAVIS Number:09.115 (Old)
DG SANTE Food Flavourings:09.115 nonyl octanoate
FEMA Number:2790 nonyl octanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: NONYL 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 oily liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.86000 @ 25.00 °C.
Refractive Index:1.43100 to 1.43500 @ 20.00 °C.
Boiling Point: 315.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000321 mm/Hg @ 25.00 °C. (est)
Flash Point: 300.00 °F. TCC ( 148.89 °C. )
logP (o/w): 0.850 (est)
Soluble in:
 alcohol
 dipropylene glycol
 water, 0.01172 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl octanoate
amyl 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
octyl octanoate
phenethyl octanoate
propyl octanoate
isopropyl octanoate
sulfuryl octanoate
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
sweet rose mushroom floral cognac
Odor Description:at 100.00 %. sweet rose mushroom floral cognac
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Nonyl Octanoate 95%
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 nonyl octanoate usage levels up to:
  1.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.14 (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: -0.06000
beverages(nonalcoholic): -2.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
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 ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :589365
National Institute of Allergy and Infectious Diseases:Data
nonyl octanoate
Chemidplus:0007786483
 
References:
 nonyl octanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7786-48-3
Pubchem (cid):589365
Pubchem (sid):135263083
 
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):HMDB34131
FooDB:FDB012405
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
nonanal diethyl acetal
FL/FR
balsamic
(E)-
benzyl tiglate
FL/FR
citrus
bitter
orange peel oil brazil
FL/FR
creamy
butyl lactate
FL/FR
earthy
dibenzyl ether
FL/FR
1-
nonen-3-ol
FL/FR
3-
octanol
FL/FR
1-
octen-3-one
FL/FR
ethereal
decyl propionate
FL/FR
ethyl formate
FL/FR
fatty
(E)-2-
decenal
FL/FR
methyl 10-undecenoate
FL/FR
fermented
iso
butyl decanoate
FL/FR
butyl laevo-lactate
FL/FR
hexanal diethyl acetal
FL/FR
3-
methyl-1-pentanol
FL/FR
floral
amyl nonanoate
FL/FR
iso
amyl undecylenate
FL/FR
benzyl alcohol
FL/FR
butyl benzyl ether
FL/FR
citronellal
FL/FR
citronellyl propionate
FL/FR
(Z)-alpha-
damascone
FL/FR
gamma-
damascone
FR
(Z)-4-
decen-1-yl acetate
FL/FR
dihydrocarvyl acetate
FL/FR
6,8-
dimethyl-2-nonanol
FR
farnesyl acetate
FL/FR
floral pyran
FR
geranium rose-scented oil cuba
FR
geranyl acetate
FL/FR
geranyl heptanoate
FL/FR
(E)-
geranyl linalool
FL/FR
hawthorn ethanol
FR
herbal pyran
FR
2-
methyl octanal
FL/FR
musk acetate
FR
neryl acetate
FL/FR
neryl isovalerate
FL/FR
nonanol
FL/FR
octyl acetate
FL/FR
phenethyl acetate
FL/FR
phenethyl anthranilate
FL/FR
phenethyl butyl ether
FR
phenethyl phenyl acetate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde digeranyl acetal
FR
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
2-
phenyl propionaldehyde ethylene glycol acetal
FR
rose acetate
FR
laevo-
rose oxide
FL/FR
styralyl propionate
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
fruity
(E)-alpha-
damascone
FL/FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
(E)-
ethyl tiglate
FL/FR
4-
heptanone
FL/FR
octyl propionate
FL/FR
strawberry glycidate 2
FL/FR
fungal
1-
decen-3-ol
FL/FR
methyl 2-furoate
FL/FR
green
iso
decanal
FL/FR
2-
heptyl tetrahydrofuran
FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-
leaf acetal
FL/FR
melon acetal
FL/FR
phenyl acetaldehyde
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
herbal
anthemis nobilis flower oil roman
FL/FR
3-
octanone
FL/FR
honey
phenethyl furoate
FL/FR
phenyl acetic acid
FL/FR
mushroom
3-
octen-2-ol
FL/FR
(R)-1-
octen-3-ol
FL/FR
1-
octen-3-yl butyrate
FL/FR
powdery
para-
anisyl alcohol
FL/FR
soapy
ethyl undecanoate
FL/FR
waxy
methyl laurate
FL/FR
(Z)-3-
nonen-1-ol
FL/FR
yeasty
2-
octen-4-one
FL/FR
For Flavor
No flavor group found for these
amyl nonanoate
FL/FR
iso
amyl undecylenate
FL/FR
butyl benzyl ether
FL/FR
iso
butyl decanoate
FL/FR
(Z)-alpha-
damascone
FL/FR
iso
decanal
FL/FR
(Z)-4-
decen-1-yl acetate
FL/FR
decyl propionate
FL/FR
geranyl heptanoate
FL/FR
(E)-
geranyl linalool
FL/FR
hexanal diethyl acetal
FL/FR
2-
methyl octanal
FL/FR
tris(
methyl thio) methane
FL
nonanal diethyl acetal
FL/FR
(E)-2-
penten-1-ol
FL
2-
pentyl-1-buten-3-one
FL
phenethyl furoate
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
balsamic
balsamic
(E)-
benzyl tiglate
FL/FR
buttery
butyl laevo-lactate
FL/FR
caramellic
methyl 2-furoate
FL/FR
citrus
styralyl propionate
FL/FR
dairy
butyl lactate
FL/FR
earthy
1-
decen-3-ol
FL/FR
1-
nonen-3-ol
FL/FR
1,8-
octane dithiol
FL
1-
octen-3-one
FL/FR
estery
octyl propionate
FL/FR
ethereal
ethyl formate
FL/FR
fatty
dimethyl sulfoxide
FL
fermented
methyl thio isovalerate
FL
floral
citronellal
FL/FR
citronellyl propionate
FL/FR
dihydrocarvyl acetate
FL/FR
farnesyl acetate
FL/FR
neryl acetate
FL/FR
phenethyl anthranilate
FL/FR
phenyl acetic acid
FL/FR
laevo-
rose oxide
FL/FR
fruity
para-
anisyl alcohol
FL/FR
benzyl alcohol
FL/FR
(E)-alpha-
damascone
FL/FR
dibenzyl ether
FL/FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
(E)-
ethyl tiglate
FL/FR
4-
heptanone
FL/FR
neryl isovalerate
FL/FR
bitter
orange peel oil brazil
FL/FR
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
strawberry glycidate 2
FL/FR
green
geranyl acetate
FL/FR
(Z)-3-
hexen-1-yl phenyl acetate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-
leaf acetal
FL/FR
melon acetal
FL/FR
4-
methyl-2-pentenal
FL
phenyl acetaldehyde dimethyl acetal
FL/FR
herbal
anthemis nobilis flower oil roman
FL/FR
honey
phenethyl acetate
FL/FR
phenethyl phenyl acetate
FL/FR
phenyl acetaldehyde
FL/FR
medicinal,
phenethyl salicylate
FL/FR
mushroom
3-
octanone
FL/FR
3-
octen-2-ol
FL/FR
(R)-1-
octen-3-ol
FL/FR
1-
octen-3-yl butyrate
FL/FR
musty
3-
octanol
FL/FR
sulfurous
1-(
methyl thio)-2-butanone
FL
2-
naphthyl mercaptan
FL
vegetable
2-
octen-4-one
FL/FR
waxy
(E)-2-
decenal
FL/FR
ethyl undecanoate
FL/FR
methyl 10-undecenoate
FL/FR
methyl laurate
FL/FR
nonanol
FL/FR
(Z)-3-
nonen-1-ol
FL/FR
octyl 2-furoate
FL
octyl acetate
FL/FR
whiskey
3-
methyl-1-pentanol
FL/FR
 
Potential Uses:
FRfloral
FRfungus
FL/FRorange bitter orange peel
FRorchid
 
Occurrence (nature, food, other):note
 orange bitter orange
Search Trop Picture
 
Synonyms:
 nonyl caprylate
 nonyl octylate
 octanoic acid nonyl ester
 octanoic acid, nonyl ester
 
 
Notes:
Used in food flavouring
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