heptyl cinnamate
cinnamic acid, heptyl ester
 
Notes:
Flavouring ingredient
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      10032-08-3 Heptyl Cinnamate
       
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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      Product(s):
      08-14450 HEPTYL CINNAMATE
       
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CAS Number: 10032-08-3Picture of molecule3D/inchi
FDA UNII: 865A76T2CD
Nikkaji Web: J184.153J
CoE Number: 2104
XlogP3: 5.50 (est)
Molecular Weight: 246.34974000
Formula: C16 H22 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: 666  heptyl cinnamate
FLAVIS Number: 09.782 (Old)
DG SANTE Food Flavourings: 09.782  heptyl cinnamate
FEMA Number: 2551  heptyl cinnamate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):10032-08-3 ; HEPTYL CINNAMATE
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.
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Physical Properties:
Appearance: pale yellow clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.98500 @  25.00 °C.
Specific Gravity: 0.98200 to 0.99000 @  25.00 °C.
Pounds per Gallon - est.: 8.171 to 8.238
Refractive Index: 1.52900 @  20.00 °C.
Refractive Index: 1.52800 to 1.53000 @  20.00 °C.
Boiling Point: 349.00 to  350.00 °C. @ 760.00 mm Hg
Boiling Point: 185.00 °C. @ 15.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.000045 mmHg @ 25.00 °C. (est)
Flash Point: 180.00 °F. TCC ( 82.22 °C. )
logP (o/w): 5.365 (est)
Soluble in:
 alcohol
 water, 0.7325 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
allyl cinnamate
amyl cinnamate
isoamyl cinnamate
benzyl cinnamate
butyl cinnamate
isobutyl cinnamate
cinnamyl cinnamate
citronellyl cinnamate
cyclohexyl cinnamate
ethyl alpha-acetyl cinnamate
ethyl cinnamate
(Z)-3-hexen-1-yl cinnamate
hexyl cinnamate
linalyl cinnamate
methyl cinnamate
octyl cinnamate
phenethyl cinnamate
3-phenyl propyl cinnamate
propyl cinnamate
isopropyl cinnamate
terpinyl cinnamate
tetrahydrofurfuryl cinnamate
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Organoleptic Properties:
 
Odor Type: green
 
Odor Strength: medium
 
 green  leafy  hyacinth  
Odor Description:
at 100.00 %. 
green fleafy hyacinth
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
Heptyl Cinnamate
Penta International
HEPTYL CINNAMATE
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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
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Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for heptyl cinnamate usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 1.50 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 52.00 (μg/capita/day)
Structure Class: I
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: -1.00000
beverages(nonalcoholic): -3.30000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: -270.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 1.000002.00000
fruit ices: 1.000002.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 1.000006.00000
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: --
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Safety References:
Flavor & Extract Manufacturers Association (FEMA) reference(s):
The FEMA GRAS assessment of cinnamyl derivatives used as flavor ingredients. View pdf
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):
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 15 (FGE.15): Aryl-substituted saturated and unsaturated primary alcohol/aldehyde/acid/ester derivatives from chemical group 22 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf
Flavouring Group Evaluation 15, Revision 1 (FGE.15Rev1) - Aryl-substituted saturated and unsaturated primary alcohol/aldehyde/acid/ester derivatives from chemical group 22 - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
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
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6435839
National Institute of Allergy and Infectious Diseases: Data
 heptyl (E)-3-phenylprop-2-enoate
Chemidplus: 0010032083
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References:
 heptyl (E)-3-phenylprop-2-enoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 10032-08-3
Pubchem (cid): 6435839
Pubchem (sid): 135017167
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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 Substances Added to Food (formerly EAFUS): View
CHEMBL: View
HMDB (The Human Metabolome Database): HMDB37705
FooDB: FDB016833
Export Tariff Code: 2916.12.6000
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
aldehydic
 muguet undecadienalFR
animal
para-cresyl phenyl acetateFL/FR
balsamic
isobutyl cinnamateFL/FR
 cinnamyl alcoholFL/FR
 cinnamyl butyrateFL/FR
 ethyl cinnamateFL/FR
(Z)-3-hexen-1-yl cinnamateFR
 linalyl cinnamateFL/FR
 octyl cinnamateFR
 peru balsam oilFL/FR
 peru balsam resinoidFL/FR
2-phenoxyethyl formateFR
3-phenyl propyl alcoholFL/FR
2-phenyl propyl alcoholFL/FR
black poplar bud oleoresinFL/FR
 tetrahydrofurfuryl cinnamateFL/FR
chemical
 styralyl alcoholFL/FR
citrus
 neroli ketoneFR
 petitgrain combava oilFR
fatty
(Z)-2-octenal 
(E)-2-octenalFL/FR
fermented
 hexanal diethyl acetalFL/FR
floral
 allyl anthranilateFL/FR
 ethyl hydrocinnamateFL/FR
 geranium pyranFR
 geranium specialtyFR
 hyacinth etherFR
 kewda absolute 
 kewda oilCS
 phenethyl formateFL/FR
 phenethyl salicylateFL/FR
 phenyl acetaldehyde / methyl anthranilate schiff's baseFR
 phenyl glycol diacetateFR
2-phenyl propionaldehyde dimethyl acetalFL/FR
2-phenyl propyl acetateFL/FR
(R)-2-phenyl propyl alcoholFL/FR
3-phenyl propyl formateFL/FR
 phenyl propyl phenyl acetateFR
3-phenyl propyl propionateFL/FR
(E)-2-phenyl-1(2)-propene-1-yl acetateFR
 reseda acetalFR
 tea acetateFR
fruity
 benzyl methyl etherFL/FR
alpha-heptyl cinnamaldehyde 
2-hexen-1-olFL/FR
(E)-2-hexen-1-olFL/FR
green
 acetaldehyde butyl phenethyl acetalFL/FR
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 acetaldehyde dipropyl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 artichoke leaf 
 bromstyrolCS
 citrus carbaldehyde / methyl anthranilate schiff's baseFR
3,5,6-neocyclocitralFR
 diphenyl oxideFL/FR
 galbanum oil terpenelessFL/FR
 galbanum oleoresinFL/FR
 galbascone (IFF)FR
 geranium absoluteFL/FR
 green etherFL/FR
1-heptanolFL/FR
3-hexen-1-olFL/FR
(Z)-2-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (E)-crotonateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
3-hexenalFL/FR
 hexoxyacetaldehyde dimethyl acetalFR
 hexyl heptanoateFL/FR
 hyacinth butanalFR
 lawsonia inermis leaf oil CO2 extractFR
(Z)-leaf acetalFL/FR
 leafy acetalFL/FR
 leafy oximeFR
 methyl heptine carbonateFL/FR
(E,Z)-2,6-nonadien-1-yl acetateFL/FR
 octanal dimethyl acetalFL/FR
(Z)-5-octen-1-yl propionateFL/FR
 phenethyl oxyacetaldehydeFR
 phenoxyacetaldehyde 50% in benzyl alcoholFR
 phenyl acetaldehyde ethylene glycol acetalFR
3-phenyl propionaldehydeFL/FR
2-phenyl propionaldehydeFL/FR
isopropyl phenyl propionaldehydeFR
 rosa damascena leaf absoluteFR
 rosacyanthinFR
 rose leaf absolute (rosa centifolia)FL/FR
 styralyl acetateFL/FR
 violet leaf oil (viola odorata)FL/FR
herbal
sweet basil absoluteFL/FR
 herbal heptaneFR
 lovage tinctureFL/FR
 methyl ortho-anisateFL/FR
 rosemary oleoresinFL/FR
minty
isopulegyl formateFL/FR
powdery
para-anisyl alcoholFL/FR
sulfurous
3-(methyl thio) hexanolFL/FR
waxy
 methyl butyl phenyl acetateFL/FR
 
For Flavor
 
No flavor group found for these
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 allyl anthranilateFL/FR
 ethyl hydrocinnamateFL/FR
alpha-heptyl cinnamaldehyde 
 hexanal diethyl acetalFL/FR
3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (E)-crotonateFL/FR
(E)-2-hexenalFL
2-hexenalFL
 hexyl heptanoateFL/FR
 kewda absolute 
 methyl furfuracrylateFL
 methyl ortho-anisateFL/FR
2-methyl-3-heptanoneFL
3-methyl-3-pentanolFL
1,5-octadien-3-olFL
(Z)-2-octenal 
2-phenyl propyl acetateFL/FR
(R)-2-phenyl propyl alcoholFL/FR
3-phenyl propyl formateFL/FR
3-phenyl propyl propionateFL/FR
black poplar bud oleoresinFL/FR
isopulegyl formateFL/FR
 tetrahydrofurfuryl cinnamateFL/FR
aromatic
 leafy acetalFL/FR
balsamic
isobutyl cinnamateFL/FR
 ethyl cinnamateFL/FR
 peru balsam oilFL/FR
 peru balsam resinoidFL/FR
chemical
 styralyl alcoholFL/FR
fatty
(Z)-3-hexen-1-yl benzoateFL/FR
(E)-2-octenalFL/FR
fruity
para-anisyl alcoholFL/FR
 benzyl methyl etherFL/FR
2-hexen-1-olFL/FR
 linalyl cinnamateFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
 styralyl acetateFL/FR
green
 acetaldehyde butyl phenethyl acetalFL/FR
 acetaldehyde dipropyl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 artichoke leaf 
 cinnamyl alcoholFL/FR
 diphenyl oxideFL/FR
 galbanum oil terpenelessFL/FR
 galbanum oleoresinFL/FR
 geranium absoluteFL/FR
 green etherFL/FR
(E)-2-hexen-1-olFL/FR
(Z)-2-hexen-1-olFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
3-hexenalFL/FR
(Z)-leaf acetalFL/FR
 methyl heptine carbonateFL/FR
(E,Z)-2,6-nonadien-1-yl acetateFL/FR
 octanal dimethyl acetalFL/FR
(Z)-5-octen-1-yl propionateFL/FR
 phenethyl formateFL/FR
2-phenyl propionaldehydeFL/FR
3-phenyl propionaldehydeFL/FR
2-phenyl propyl alcoholFL/FR
 rose leaf absolute (rosa centifolia)FL/FR
 violet leaf oil (viola odorata)FL/FR
herbal
sweet basil absoluteFL/FR
 lovage tinctureFL/FR
 rosemary oleoresinFL/FR
leafy
 methyl butyl phenyl acetateFL/FR
medicinal,
 phenethyl salicylateFL/FR
metallic
3-(methyl thio) hexanolFL/FR
phenolic
para-cresyl phenyl acetateFL/FR
solvent
1-heptanolFL/FR
3-phenyl propyl alcoholFL/FR
winey
 cinnamyl butyrateFL/FR
 
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Potential Uses:
 balsamFR
 greenFR
 herbalFR
 hyacinthFR
 hydrangeaFR
 leaf 
 mossFR
 natural 
 orientalFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 cinnamic acid heptyl ester
 cinnamic acid, heptyl ester
 heptyl (E)-3-phenylprop-2-enoate
 heptyl 3-phenyl propenoate
 heptyl 3-phenylpropenoate
 heptyl beta-phenyl acrylate
3-phenyl-2-propenoic acid heptyl ester
2-propenoic acid, 3-phenyl-, heptyl ester
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