3-[3-(Methoxycarbonyl)-2-thienyl]benzoic acid
[CAS# 893735-30-3]

Identification

• Name: 3-[3-(Methoxycarbonyl)-2-thienyl]benzoic acid
• Synonyms: 3-[3-(Methoxycarbonyl)-2-thienyl]benzoesäure; 3-[3-(Methoxycarbonyl)-2-thienyl]benzoic acid; 3-Thiophenecarboxylic acid, 2-(3-carboxyphenyl)-, 3-methyl ester
• Molecular Formula: C₁₃H₁₀O₄S
• Molecular Weight: 262.28
• CAS Registry Number: 893735-30-3
• SMILES: COC(=O)c1ccsc1c2cccc(c2)C(=O)O
• InChI: 1S/C13H10O4S/c1-17-13(16)10-5-6-18-11(10)8-3-2-4-9(7-8)12(14)15/h2-7H,1H3,(H,14,15)
• InChIKey: BCEXOEQMCXJREV-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 469.1±40.0°C at 760 mmHg (Cal.)
• Flash point: 237.5±27.3°C (Cal.)
• Refractive index: 1.615 (Cal.)