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methyl 2-thenoate
2-thiophenecarboxylic acid, methyl ester

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Name:methyl thiophene-2-carboxylate
CAS Number: 5380-42-7Picture of molecule3D/inchi
FDA UNII: Search
Nikkaji Web:J45.103G
MDL:MFCD00016895
XlogP3:2.00 (est)
Molecular Weight:142.17722000
Formula:C6 H6 O2 S
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge 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
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:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 200.00 to 201.00 °C. @ 760.00 mm Hg (est)
Boiling Point: 98.00 °C. @ 24.00 mm Hg
Vapor Pressure:0.271000 mmHg (est)
Flash Point: 167.00 °F. TCC ( 74.90 °C. ) (est)
logP (o/w): 1.830
Soluble in:
 alcohol
 water, 2244 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Flavor Type: fruity
grape burnt
Taste Description: anthranilate-like taste with burnt note
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Methyl 2-Thiophenecarboxylate
Matrix Scientific
For experimental / research use only.
Methyl thiophene-2-carboxylate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Methyl thiophene-2-carboxylate 97%
TCI AMERICA
For experimental / research use only.
Methyl 2-Thiophenecarboxylate >99.0%(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:
information only not used for fragrances or flavors
Recommendation for methyl 2-thenoate usage levels up to:
 not for fragrance use.
 
Recommendation for methyl 2-thenoate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :79340
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
methyl thiophene-2-carboxylate
Chemidplus:0005380427
 
References:
 methyl thiophene-2-carboxylate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):79340
Pubchem (sid):135037369
 
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):HMDB29719
FooDB:FDB000913
Export Tariff Code:2934.99.9000
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-(carbomethoxy)thiophene
2-(methoxycarbonyl)thiophene
2-(methoxycarbonyl)thiophene; methyl 2-thenoate
 methyl 2-thiophene carboxylate
 methyl 2-thiophenecarboxylate
 methyl thiophene-2-carboxylate
 methyl-2-thiophene carboxylate
2-thiophene carboxylic acid methyl ester
 thiophene-2-carboxylic acid methyl ester
2-thiophenecarboxylic acid methyl ester
2-thiophenecarboxylic acid, methyl ester
 
 
Notes:
Maillard product
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