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furfuryl heptanoate
heptanoic acid, 2-furanylmethyl ester

Sponsors

Name:furan-2-ylmethyl heptanoate
CAS Number: 39481-28-2Picture of molecule3D/inchi
MDL:MFCD00209508
XlogP3-AA:3.20 (est)
Molecular Weight:210.27306000
Formula:C12 H18 O3
NMR Predictor:Predict (works with chrome 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
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.00100 @ 25.00 °C.
Refractive Index:1.45900 @ 20.00 °C.
Boiling Point: 266.00 to 267.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.008000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 3.747 (est)
Soluble in:
 alcohol
 water, 17.87 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl heptanoate
amyl heptanoate
isoamyl heptanoate
benzyl heptanoate
butyl heptanoate
isobutyl heptanoate
decyl heptanoate
ethyl 2-acetyl heptanoate
ethyl heptanoate
eugenyl heptanoate
geranyl heptanoate
heptyl heptanoate
(Z)-3-hexen-1-yl heptanoate
hexyl heptanoate
methyl heptanoate
nonyl heptanoate
octyl heptanoate
phenethyl heptanoate
prenyl heptanoate
propyl heptanoate
 
Organoleptic Properties:
Odor Strength:medium
Odor Description:at 100.00 %. green
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Synerzine
Furfuryl Heptanoate
 
Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
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 - Wear suitable protective clothing.
 
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: flavoring agents
Recommendation for furfuryl heptanoate usage levels up to:
 not for fragrance use.
 
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :557223
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
furan-2-ylmethyl heptanoate
 
References:
 furan-2-ylmethyl heptanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):557223
Pubchem (sid):103820439
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
HMDB (The Human Metabolome Database):Search
ChemSpider:View
EFSA Update of results on the monitoring of furan levels in food:Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:Read Report
 
Potential Blenders and core components note
For Odor
aldehydic
dodecanal (aldehyde C-12 lauric)
FL/FR
fresh carbaldehyde
FR
lily pentanal
FR
2-
methyl undecanal dimethyl acetal
FR
undecanal
FL/FR
balsamic
iso
amyl benzoate
FL/FR
guaiyl acetate
FL/FR
citrus
(E)-2-
tetradecenal
FL/FR
creamy
3-
heptyl dihydro-5-methyl-2(3H)-furanone
FL/FR
fatty
3-
decen-2-one
FL/FR
methyl 2-hexenoate
FL/FR
(E)-2-
nonenal
FL/FR
2-
octenal
FL/FR
(E)-2-
octenal
FL/FR
floral
geranyl acetate
FL/FR
hexyl 2-furoate
FL/FR
hydroxycitronellal
FL/FR
hydroxycitronellal dimethyl acetal
FL/FR
jasmin cyclopentanol
FR
fruity
allyl cyclohexyl acetate
FL/FR
cyclohexyl propionate
FL/FR
ethyl 2-octenoate
FL/FR
ethyl hexanoate
FL/FR
grape butyrate
FL/FR
methyl 2-methyl butyrate
FL/FR
2-
methyl butyl 2-methyl butyrate
FL/FR
octen-1-yl cyclopentanone
FL/FR
green
dodecanal dimethyl acetal
FL/FR
ethyl (E,Z)-2,4-decadienoate
FL/FR
heptanal cyclic propylene acetal
FL/FR
3-
heptanone
FL/FR
(Z)-4-
heptenal
FL/FR
2-
heptenal
FL/FR
heptyl formate
FL/FR
2-
heptyl furan
FL/FR
hexanal (aldehyde C-6)
FL/FR
(Z)-3-
hexen-1-yl formate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
hexyl 2-methyl butyrate
FL/FR
alpha-
hexyl cinnamaldehyde dimethyl acetal
FR
hexyl octanoate
FL/FR
hexyl phenyl acetate
FL/FR
melon nonenoate
FL/FR
neryl butyrate
FL/FR
(E,Z)-3,6-
nonadien-1-ol
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
(E,Z)-2,6-
nonadienal
FL/FR
(E)-2-
nonen-1-ol
FL/FR
(E)-2-
octen-1-yl acetate
FL/FR
phenyl acetaldehyde ethylene glycol acetal
FR
melon
(Z)-6-
nonen-1-ol
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
decanal diethyl acetal
FL/FR
9-
decenoic acid
FL/FR
methyl butyl phenyl acetate
FL/FR
(E)-
methyl geranate
FL/FR
2-
methyl heptanoic acid
FL/FR
methyl octanoate
FL/FR
2,4-
nonadien-1-ol
FL/FR
2-
nonanol
FL/FR
(Z)-3-
nonen-1-ol
FL/FR
octanol
FL/FR
octyl isobutyrate
FL/FR
phenethyl octanoate
FL/FR
For Flavor
No flavor group found for these
epoxy-2-decenal
FL
furfuryl hexanoate
FL
guaiyl acetate
FL/FR
heptanal cyclic propylene acetal
FL/FR
2-
heptenal
FL/FR
hexanal butane-2,3-diol acetal
FL
hexanal octane-1,3-diol acetal
FL
hexyl (E)-2-hexenoate
FL
methyl 2-hexenoate
FL/FR
(E)-
methyl geranate
FL/FR
2-
octenal
FL/FR
creamy
creamy
octyl isobutyrate
FL/FR
fatty
2,4-
decadienal
FL
(E,E)-2,4-
heptadienal
FL
heptyl formate
FL/FR
2-
heptyl furan
FL/FR
2,4-
nonadien-1-ol
FL/FR
2,4-
nonadienal
FL
(E)-2-
octenal
FL/FR
fruity
allyl cyclohexyl acetate
FL/FR
iso
amyl benzoate
FL/FR
cyclohexyl propionate
FL/FR
ethyl 2-octenoate
FL/FR
ethyl hexanoate
FL/FR
3-
heptyl dihydro-5-methyl-2(3H)-furanone
FL/FR
hexyl phenyl acetate
FL/FR
methyl 2-methyl butyrate
FL/FR
2-
methyl butyl 2-methyl butyrate
FL/FR
octen-1-yl cyclopentanone
FL/FR
phenethyl octanoate
FL/FR
green
3-
decen-2-one
FL/FR
dihydroxyacetophenone (mixed isomers)
FL
dodecanal dimethyl acetal
FL/FR
ethyl (E,Z)-2,4-decadienoate
FL/FR
geranyl acetate
FL/FR
grape butyrate
FL/FR
(Z)-4-
heptenal
FL/FR
hexanal (aldehyde C-6)
FL/FR
(Z)-3-
hexen-1-yl formate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
hexyl 2-furoate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl octanoate
FL/FR
melon nonenoate
FL/FR
methyl octanoate
FL/FR
neryl butyrate
FL/FR
(E,Z)-3,6-
nonadien-1-ol
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
(E,Z)-2,6-
nonadienal
FL/FR
(E)-2-
nonen-1-ol
FL/FR
(E)-2-
nonenal
FL/FR
(E,E)-2,4-
octadienal
FL
(E)-2-
octen-1-yl acetate
FL/FR
ketonic
3-
heptanone
FL/FR
leafy
methyl butyl phenyl acetate
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
decanal diethyl acetal
FL/FR
9-
decenoic acid
FL/FR
hydroxycitronellal
FL/FR
hydroxycitronellal dimethyl acetal
FL/FR
2-
methyl heptanoic acid
FL/FR
2-
nonanol
FL/FR
(Z)-6-
nonen-1-ol
FL/FR
(Z)-3-
nonen-1-ol
FL/FR
octanol
FL/FR
(E)-2-
tetradecenal
FL/FR
undecanal
FL/FR
 
Potential Uses:
FLgreen
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 furan-2-ylmethyl heptanoate
 furan-2-ylmethylheptanoate
 furfuryl capronate
2-furfuryl heptanoate
 furfuryl oenanthate
 furfurylheptanoate
2-furylmethyl heptanoate
 heptanoic acid 2-furfuryl ester
 heptanoic acid, 2-furanylmethyl ester
 

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