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

3-phenyl propyl crotonate
2-butenoic acid 3-phenylpropyl ester

Supplier Sponsors

CAS Number: 68922-07-6Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:272-979-4
Nikkaji Web:J155.186H
XlogP3:3.40 (est)
Molecular Weight:204.26892000
Formula:C13 H16 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:information only not used for fragrances or flavors
 
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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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 302.00 to 305.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.001000 mm/Hg @ 25.00 °C. (est)
Flash Point: 340.00 °F. TCC ( 171.11 °C. )
logP (o/w): 3.862 (est)
Soluble in:
 water, 22.29 mg/L @ 25 °C (est)
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(Z)-3-hexen-1-yl (E)-crotonate
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Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
3-Phenylpropyl Crotonate
Grau Aromatics
PHENYL-3-PROPYL-CROTONATE
SRS Aromatics
PHENYL 3 PROPYL CROTONATE
 
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: information only not used for fragrances or flavors
Recommendation for 3-phenyl propyl crotonate usage levels up to:
 not for fragrance use.
 
Recommendation for 3-phenyl propyl crotonate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68922-07-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5356248
National Institute of Allergy and Infectious Diseases:Data
3-phenylpropyl (E)-but-2-enoate
Chemidplus:0068922076
 
References:
 3-phenylpropyl (E)-but-2-enoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):5356248
Pubchem (sid):135055076
 
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
Export Tariff Code:2916.19.7000
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-butenoic acid 3-phenyl propyl ester
2-butenoic acid 3-phenylpropyl ester
3-phenyl propyl 2-butenoate
 phenyl-3-propyl crotonate
3-phenylpropyl (E)-but-2-enoate
3-phenylpropyl 2-butenoate
3-phenylpropyl crotonate
 

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