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

alpha-amyl cinnamyl isovalerate
alpha-pentylcinnamyl isovalerate

Supplier Sponsors

Name:2-(phenylmethylidene)heptyl 3-methylbutanoate
CAS Number: 7493-80-3Picture of molecule3D/inchi
FDA UNII: ZR2O0NCP37
CoE Number:463
XlogP:5.90 (est)
Molecular Weight:288.43056000
Formula:C19 H28 O2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Name:[(2E)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
CAS Number: 7493-80-3 (E)Picture of molecule3D/inchi
FDA UNII: Search
XlogP:5.90 (est)
Molecular Weight:288.43056000
Formula:C19 H28 O2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Name:[(2Z)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
CAS Number: 7493-80-3 (Z)Picture of molecule3D/inchi
FDA UNII: ZR2O0NCP37
XlogP3-AA:6.20 (est)
Molecular Weight:288.43056000
Formula:C19 H28 O2
NMR Predictor:Predict (works with chrome, Edge 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
PubMed:Search
NCBI:Search
JECFA Food Flavoring:678 alpha-amylcinnamyl isovalerate
DG SANTE Food Flavourings:09.468 alpha-pentylcinnamyl isovalerate
FEMA Number:2067 alpha-amylcinnamyl isovalerate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):7493-80-3 ; ALPHA-AMYLCINNAMYL ISOVALERATE
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: 97.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity:0.93900 to 0.95900 @ 25.00 °C.
Pounds per Gallon - (est).: 7.813 to 7.980
Refractive Index:1.49800 to 1.50800 @ 20.00 °C.
Boiling Point: 392.00 to 393.00 °C. @ 760.00 mm Hg (est)
Boiling Point: 171.00 °C. @ 4.00 mm Hg
Flash Point: 253.00 °F. TCC ( 122.78 °C. )
logP (o/w): 6.470 (est)
Soluble in:
 alcohol
 water, 0.02419 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
alpha-amyl cinnamyl acetate
alpha-amyl cinnamyl alcohol
alpha-amyl cinnamyl formate
 
Organoleptic Properties:
Odor Type: fruity
fruity tobacco oily hay
Odor Description:at 100.00 %. fruity tobacco oily hay
Flavor Type: fruity
oily fruity hay spicy
Taste Description: oily fruity hay spicy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
alpha-Amyl Cinnamyl Isovalerate
Parchem
alpha-Amyl Cinnamyl Isovalerate
Penta International
ALPHA-AMYLCINNAMYL ISOVALERATE
Synerzine
alpha-Amylcinnamyl Isovalerate
 
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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for alpha-amyl cinnamyl isovalerate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.50 (μg/capita/day)
Structure Class: II
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
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: -1.70000
beverages(nonalcoholic): -0.36000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: -1.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -1.20000
fruit ices: -1.20000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -1.30000
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 214: alpha,beta-Unsaturated aldehydes and precursors from chemical subgroup 3.1 of FGE.19: Cinnamyl derivatives[1]
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 68 (FGE.68): Consideration of cinnamyl alcohol and related flavouring agents evaluated by JECFA (55th meeting) evaluated by EFSA in FGE.15Rev1 (2008)
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
National Institute of Allergy and Infectious Diseases:Data
2-(phenylmethylidene)heptyl 3-methylbutanoate
Chemidplus:0007493803
[(2E)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
[(2Z)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
 
References:
 2-(phenylmethylidene)heptyl 3-methylbutanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7493-80-3
Pubchem (sid):135019027
 [(2E)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7493-80-3
 [(2Z)-2-(phenylmethylidene)heptyl] 3-methylbutanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7493-80-3
Pubchem (cid):6435835
Pubchem (sid):135019027
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (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):HMDB36205
FooDB:FDB015063
Export Tariff Code:2915.60.0000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
amber
amber
ambrette seed absolute
FL/FR
animal
para-
cresyl caprylate
FL/FR
6-
methyl quinoline
FL/FR
anisic
amyl furoate
FL/FR
balsamic
amyl phenyl acetate
FL/FR
benzyl cinnamate
FL/FR
camphoreous
beta-homo
cyclocitral
FL/FR
caramellic
immortelle absolute
FL/FR
cereal
bran absolute
FR
citrus
2-
heptanol
FL/FR
verbena absolute france
FL/FR
coconut
gamma-
heptalactone
FL/FR
coumarinic
coumane
FL/FR
tonka furanone
FL/FR
earthy
3-
octen-2-one
FL/FR
ethereal
acetaldehyde dimethyl acetal
FL/FR
fatty
butyl undecylenate
FL/FR
(E,Z,Z)-2,4,7-
tridecatrienal
FL/FR
fermented
methyl decanoate
FL/FR
floral
acetal 318
FR
iso
amyl angelate
FL/FR
alpha-
amyl cinnamaldehyde
FL/FR
iso
amyl geranate
FR
para-
anisyl nitrile
FR
benzyl acetate
FL/FR
benzyl acetoacetate
FL/FR
benzyl formate
FL/FR
benzyl isobutyrate
FL/FR
boronia butenal
FR
delta-
damascone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
jasmin lactone (IFF)
FL/FR
menthadienyl formate
FR
methoxymelonal
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
muguet carbinol
FL/FR
ocean propanal
FL/FR
petitgrain lemon oil
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl isovalerate
FL/FR
tobacco flower absolute
FR
fruity
iso
amyl octanoate
FL/FR
butyl 2-decenoate
FL/FR
cherry oxyacetate
FL/FR
cyclohexanone diethyl acetal
FL/FR
beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
dibutyl sebacate
FL/FR
eriocephalus punctulatus flower oil
FR
ethyl 3-hydroxyhexanoate
FL/FR
geranyl isovalerate
FL/FR
leather propionate
FR
3-
mercaptohexyl acetate
FL/FR
methyl nonane dione
FL/FR
phenoxyethyl propionate
FL/FR
rhubarb pyran
FR
solanone
FL/FR
fungal
methyl 2-furoate
FL/FR
green
iso
amyl 3-(2-furan) propionate
FL/FR
para-
dimethyl hydroquinone
FL/FR
(E)-2-
hexen-1-yl butyrate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
hexoxyacetaldehyde dimethyl acetal
FR
magnolia flower oil
FL/FR
melon nonenoate
FL/FR
3,5,5-
trimethyl hexanol
FL/FR
hay
beeswax absolute
FL/FR
hay absolute
FR
para-
methyl phenoxyacetaldehyde
FR
tobacco leaf absolute
FL/FR
woodruff absolute
FR
herbal
acorn acetate
FR
chamomile valerate
FR
clary propyl acetate
FR
clary sage absolute
FL/FR
matricaria chamomilla flower oil
FL/FR
methyl cyclogeranate (Firmenich)
FR
methyl nicotinate
FL/FR
1-
octen-3-yl acetate
FL/FR
beta-
pinene
FL/FR
laevo-beta-
pinene
FL/FR
saffron indenone
FL/FR
safranal
FL/FR
theaspirane
FL/FR
yerba mate absolute
FL/FR
honey
phenyl acetic acid
FL/FR
mossy
oakmoss phenol
FR
musk
musk nonane
FR
musty
ketoiso
phorone
FL/FR
nutty
2-
acetyl-5-methyl furan
FL/FR
oily
petal pyranone
FL/FR
phenolic
2'-
hydroxyacetophenone
FL/FR
popcorn
2-
acetyl pyridine
FL/FR
spicy
N,N-
diethyl octanamide
FR
terpenic
D-(+)-beta-
pinene
FL/FR
tobacco
para-
cresyl isovalerate
FL/FR
3-
ethyl pyridine
FL/FR
methyl benzoxole
FL/FR
(E,E/E,Z)-
tobacco cyclohexenone
FL/FR
veltonal (Bedoukian)
FR
tonka
coumarin
FR
deertongue absolute
FR
flouve absolute
FR
gamma-
hexalactone
FL/FR
mint lactone
FL/FR
saffron resinoid
FL/FR
tonka undecanone
FR
vanilla
propenyl guaethol
FL/FR
woody
amber decatriene
FR
alpha-
cedrene epoxide
FR
iso
longifolene ketone
FR
tobacarol (IFF)
FR
tobacco nonene
FR
woody dioxolane
FR
woody ether
FR
For Flavor
No flavor group found for these
amyl angelate
FL
iso
amyl angelate
FL/FR
amyl furoate
FL/FR
amyl phenyl acetate
FL/FR
coumane
FL/FR
cyclohexanone diethyl acetal
FL/FR
dibutyl sebacate
FL/FR
2,4-
difurfuryl furan
FL
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-one
FL/FR
fig leaf absolute
FL
jasmin lactone (IFF)
FL/FR
magnolia flower oil
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
methyl nicotinate
FL/FR
methyl nonane dione
FL/FR
laevo-beta-
pinene
FL/FR
D-(+)-beta-
pinene
FL/FR
2-
propyl pyridine
FL
solanone
FL/FR
taraxacum officinale leaf extract
FL
tonka furanone
FL/FR
iso
amyl 3-(2-furan) propionate
FL/FR
benzyl acetoacetate
FL/FR
beta-
damascone
FL/FR
animal
animal
para-
cresyl caprylate
FL/FR
6-
methyl quinoline
FL/FR
bitter
(E,Z,Z)-2,4,7-
tridecatrienal
FL/FR
brown
beeswax absolute
FL/FR
caramellic
3-
ethyl pyridine
FL/FR
methyl 2-furoate
FL/FR
citrus
petitgrain lemon oil
FL/FR
ketoiso
phorone
FL/FR
verbena absolute france
FL/FR
cooling
beta-homo
cyclocitral
FL/FR
theaspirane
FL/FR
corn
2-
acetyl pyridine
FL/FR
creamy
gamma-
hexalactone
FL/FR
mint lactone
FL/FR
3-
octen-2-one
FL/FR
ethereal
acetaldehyde dimethyl acetal
FL/FR
fatty
methyl decanoate
FL/FR
floral
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
muguet carbinol
FL/FR
ocean propanal
FL/FR
phenyl acetic acid
FL/FR
fruity
iso
amyl octanoate
FL/FR
benzyl acetate
FL/FR
benzyl formate
FL/FR
benzyl isobutyrate
FL/FR
butyl 2-decenoate
FL/FR
cherry oxyacetate
FL/FR
(E)-beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-2-
decenoic acid
FL
ethyl 3-hydroxyhexanoate
FL/FR
2-
heptanol
FL/FR
2-
hexyl-4-acetoxytetrahydrofuran
FL
methoxymelonal
FL/FR
phenethyl isovalerate
FL/FR
grassy
tobacco leaf absolute
FL/FR
green
para-
dimethyl hydroquinone
FL/FR
geranyl isovalerate
FL/FR
(E)-2-
hexen-1-yl butyrate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
immortelle absolute
FL/FR
melon nonenoate
FL/FR
methyl 2-undecynoate
FL
1-
octen-3-yl acetate
FL/FR
3,5,5-
trimethyl hexanol
FL/FR
hay
lactadione
FL
herbal
clary sage absolute
FL/FR
matricaria chamomilla flower oil
FL/FR
saffron indenone
FL/FR
yerba mate absolute
FL/FR
honey
phenethyl isobutyrate
FL/FR
lactonic
gamma-
heptalactone
FL/FR
naphthyl
2'-
hydroxyacetophenone
FL/FR
nutty
2-
acetyl-5-methyl furan
FL/FR
methyl benzoxole
FL/FR
(E,E/E,Z)-
tobacco cyclohexenone
FL/FR
oily
petal pyranone
FL/FR
phenolic
para-
cresyl isovalerate
FL/FR
pine
beta-
pinene
FL/FR
spicy
benzyl cinnamate
FL/FR
jalapeno oleoresin
FL
paprika oleoresin
FL
sweet
saffron resinoid
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
3-
mercaptohexyl acetate
FL/FR
vanilla
propenyl guaethol
FL/FR
waxy
butyl undecylenate
FL/FR
mimosa absolute
FL/FR
mimosa absolute france
FL/FR
mimosa absolute india
FL/FR
phenoxyethyl propionate
FL/FR
woody
ambrette seed absolute
FL/FR
delta-
damascone
FL/FR
safranal
FL/FR
 
Potential Uses:
FRamber
FRchocolate
FLfruit tropical fruit
FRhay new mown hay
FRjasmin
FRmoss
FRmusk
FLnut
FRtobacco
FRtonka bean
FLtropical
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
alpha-amyl cinnamyl isovalerianate
alpha-N-amyl-beta-phenyl acryl 3-methyl butanoate
alpha-N-amyl-beta-phenyl acryl isovalerate
alpha-amylcinnamyl isovalerate
alpha-amylcinnamyl isovalerianate
 floxin isovalerate
alpha-pentyl cinnamyl isovalerate
alpha-pentyl cinnamyl isovalerianate
a-pentylcinnamyl isovalerate
alpha-pentylcinnamyl isovalerate
alpha-pentylcinnamyl isovalerianate
2-(phenylmethylene)heptyl 3-methylbutanoate
2-(phenylmethylidene)heptyl 3-methylbutanoate
 
 
Notes:
Flavouring ingredient
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