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ethyl 2-methyl benzoate
o-toluic acid, ethyl ester (8CI)

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Name:ethyl 2-methylbenzoate
CAS Number: 87-24-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:201-734-6
FDA UNII: 384Q41M534
Nikkaji Web:J47.822I
Beilstein Number:2042517
MDL:MFCD00009112
XlogP3:3.10 (est)
Molecular Weight:164.20404000
Formula:C10 H12 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
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
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
Specific Gravity:1.03500 to 1.03700 @ 20.00 °C.
Pounds per Gallon - (est).: 8.622 to 8.639
Refractive Index:1.50700 to 1.50900 @ 20.00 °C.
Boiling Point: 227.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.100000 mmHg @ 25.00 °C. (est)
Flash Point: 197.00 °F. TCC ( 91.67 °C. )
logP (o/w): 3.190 (est)
Soluble in:
 water, 233.3 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Santa Cruz Biotechnology
For experimental / research use only.
Ethyl 2-methylbenzoate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Ethyl 2-methylbenzoate 99%
TCI AMERICA
For experimental / research use only.
Ethyl o-Toluate >98.0%(GC)
 
Safety Information:
Preferred SDS: View
 
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:
natural substances and extractives
Recommendation for ethyl 2-methyl benzoate usage levels up to:
 not for fragrance use.
 
Recommendation for ethyl 2-methyl benzoate 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):87-24-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :66598
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
ethyl 2-methylbenzoate
Chemidplus:0000087241
 
References:
 ethyl 2-methylbenzoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:87-24-1
Pubchem (cid):66598
Pubchem (sid):135025589
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2916.39.7900
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
 benzoic acid, 2-methyl-, ethyl ester
 ethyl 2-methylbenzoate
 ethyl o-toluate
 ethyl ortho-toluate
 ethyl orthotoluate
2-methyl benzoic acid ethyl ester
2-methylbenzoic acid ethyl ester
o-toluic acid, ethyl ester (8CI)
 
 
Notes:
None found
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