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methyl 2-methyl benzoate
benzoic acid, 2-methyl-, methyl ester (9CI)

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Fragrance Demo Formulas
Name:methyl 2-methylbenzoate
CAS Number: 89-71-4Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:201-932-2
FDA UNII:MC8KDB9FUW
Nikkaji Web:J45.108H
MDL:MFCD00008428
XlogP3:2.80 (est)
Molecular Weight:150.17710000
Formula:C9 H10 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category: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
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.06900 to 1.07300 @ 20.00 °C.
Pounds per Gallon - (est).: 8.906 to 8.939
Refractive Index:1.51800 to 1.52000 @ 20.00 °C.
Boiling Point: 215.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.200000 mmHg @ 25.00 °C. (est)
Flash Point: 180.00 °F. TCC ( 82.22 °C. )
logP (o/w): 2.750
Soluble in:
 water, 339.5 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
floral ylang orangeflower grape
Odor Description:at 100.00 %. floral ylang orangeflower grape
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Santa Cruz Biotechnology
For experimental / research use only.
Methyl 2-methylbenzoate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Methyl 2-methylbenzoate 99%
TCI AMERICA
For experimental / research use only.
Methyl 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: fragrance agents
 
Recommendation for methyl 2-methyl benzoate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):89-71-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :33094
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
methyl 2-methylbenzoate
Chemidplus:0000089714
 
References:
 methyl 2-methylbenzoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):33094
Pubchem (sid):135023541
Pherobase:View
 
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
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-, methyl ester
 benzoic acid, 2-methyl-, methyl ester (9CI)
 benzoic acid, methyl-, methyl ester
 methyl 2-methylbenzoate
 methyl ester of 2-methylbenzoic acid
 methyl methylbenzoate
 methyl o-methylbenzoate
 methyl o-toluate
 methyl orthotoluate
 methyl toluate
 methyl-2-methylbenzoate
 methyl-o-methyl benzoate
 methyl-ortho-toluate
2-methylbenzoic acid methyl ester
2-methylbenzoic acid, methyl ester
o-toluic acid methyl ester
o-toluic acid, methyl ester (8CI)
o-toluylic acid, methyl ester
 ylanganate
 

Articles:

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Notes:
None found
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