| Weight | 142.179 g/mol |
|---|---|
| Formula | C6H6O2S |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 1 |
3-Methyl-2-thiophenecarboxylic acid (23806-24-8)
23806-24-8 · 3-methylthiophene-2-carboxylic acid
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- Discovery and development of 5-[(5S,9R)-9-(4-cyanophenyl)-3-(3,5-dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4.4]non-7-yl-methyl]-3-thiophenecarboxylic acid (BMS-587101)--a small molecule antagonist of leukocyte function associated antigen-1. (Journal of Medicinal Chemistry, 2006)
- Metabolite Generation via Microbial Biotransformations with Actinomycetes: Rapid Screening for Active Strains and Biosynthesis of Important Human Metabolites of Two Development-Stage Compounds, 5-[(5S,9R)-9-(4-Cyanophenyl)-3-(3,5-dichlorophenyl)-1-methyl-2,4-dioxo-1,3,7-triazaspiro[4.4]non7-yl-methyl]-3-thiophenecarboxylic Acid (BMS-587101) and Dasatinib (Drug Metabolism and Disposition, 2008)
- The regioselective side-chain lithiation of 2-methyl-3-thiophenecarboxylic acid. (Bulletin of the Chemical Society of Japan, 1989)
- New process for the industrial synthesis of the methyl diester of 5-amino-3-carboxymethyl-4-cyano-2-thiophenecarboxylic acid, and application to the synthesis of bivalent salts ofranelic acid and thei (2003)
- 5- [bis (carboxymethyl) amino] -3-carboxymethyl new industrial synthesis of tetraesters of methyl 4-cyano-2-thiophenecarboxylic acid, and divalent salts and their hydrates of ranelate application to the synthesis (2003)
- New industrial synthesis of methyl diester of 5-amino-3-carboxymethyl-4-cyano-2-thiophenecarboxylic acid, and divalent salts and application to the synthesis of their hydrates of ranelate (2003)
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 23806-24-8
- 3-methylthiophene-2-carboxylic acid
-
SMILESCC1=C(SC=C1)C(=O)O
-
InChIKeyIFLKEBSJTZGCJG-UHFFFAOYSA-N
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Most-cited Publications
Safety
Trends
Alternate Names
Estimated Properties
| Boiling Point | 246.01 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 274.65 C | EPI Suite |
| Density | 1.27 g/cm3 | EPA T.E.S.T. |
| Flash Point | 104.84 C | EPA T.E.S.T. |
| Melting Point | 76.02 C | EPI Suite |
| Water Solubility | 5201.12 mg/L | EPA T.E.S.T. |
| Water Solubility | 1293.1 mg/L | EPI Suite |
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