5-Methyl-3-(2-Thienyl)Isoxazole-4-Carboxylic Acid
[CAS# 83817-53-2]

Identification

• Name: 5-Methyl-3-(2-Thienyl)Isoxazole-4-Carboxylic Acid
• Synonyms: 5-Methyl-3-(2-Thienyl)Isoxazole-4-Carboxylic Acid; 5-Methyl-3-(2-Thienyl)-4-Isoxazolecarboxylic Acid
• Molecular Formula: C₉H₇NO₃S
• Molecular Weight: 209.22
• CAS Registry Number: 83817-53-2
• EINECS: 280-953-9
• SMILES: C1=C(SC=C1)C2=NOC(=C2C(=O)O)C
• InChI: 1S/C9H7NO3S/c1-5-7(9(11)12)8(10-13-5)6-3-2-4-14-6/h2-4H,1H3,(H,11,12)
• InChIKey: QSTCJVAUTDWHRS-UHFFFAOYSA-N

Properties

• Density: 1.404g/cm³ (Cal.)
• Boiling point: 365.772°C at 760 mmHg (Cal.)
• Flash point: 175.013°C (Cal.)