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gamma-methyl cinnamyl acetate

fragrance agents
2D:
3D:
CAS Number: 20883-16-3
ECHA EC Number: 244-098-5
FDA UNII: Search
Category: fragrance agents
IUPAC Name: gamma-methyl cinnamyl acetate
InChI : InChI=1/C12H14O2/c1-10(8-9-14-11(2)13)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
Std.InChI: InChI=1S/C12H14O2/c1-10(8-9-14-11(2)13)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey : NVIVTRAAPVVZKY-UHFFFAOYAE
Std.InChIKey: NVIVTRAAPVVZKY-UHFFFAOYSA-N
SMILES : CC(=CCOC(=O)C)C1=CC=CC=C1
Molar Refractivity : 56.45 ± 0.3 cm3 (est)
Parachor : 454.6 ± 4.0 cm3 (est)
Index of Refraction : 1.516 ± 0.02 (est)
Surface Tension : 35.1 ± 3.0 dyne/cm (est)
Density : 1.018 ± 0.06 g/cm3 (est)
Polarizability : 22.38 ± 0.5 10-24cm3 (est)

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

Physical Properties:

Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 281.00 to 282.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.003000 mmHg @ 25.00 °C. (est)
Flash Point: 254.00 °F. TCC ( 123.50 °C. ) (est)
logP (o/w): 3.059 (est)
Soluble in:
alcohol
water, 61.75 mg/L @ 25 °C (est)
Insoluble in:
water

Cosmetic Information:

Suppliers:

Aston Chemical
For experimental / research use only.
3-Phenyl-2-butenyl acetate
BOC Sciences
For experimental / research use only.
3-Phenyl-2-butenyl acetate

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:
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 gamma-methyl cinnamyl acetate flavor usage levels up to:
not for flavor use.

Safety References:

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):20883-16-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :89399
National Institute of Allergy and Infectious Diseases:Data
3-phenylbut-2-enyl acetate
Chemidplus:0020883163

References:

3-phenylbut-2-enyl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:20883-16-3
Pubchem (cid):89399
Pubchem (sid):135047104

Other Information:

Potential Blenders and core components :

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):

not found in nature

Synonyms:

2-buten-1-ol, 3-phenyl-, acetate
3-phenyl-2-butenyl acetate
3-phenylbut-2-enyl acetate

Articles:

None found yet. Try the PubMed Search.
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