3-(5-Chloro-2-Thienyl)-5-Methylisoxazole-4-Carboxylic Acid
[CAS# 14345-96-1]

Identification

• Name: 3-(5-Chloro-2-Thienyl)-5-Methylisoxazole-4-Carboxylic Acid
• Synonyms: 3-(5-Chloro-2-Thienyl)-5-Methyl-Isoxazole-4-Carboxylic Acid; 3-(5-Chloro-2-Thienyl)-5-Methyl-4-Isoxazolecarboxylic Acid
• Molecular Formula: C₉H₆ClNO₃S
• Molecular Weight: 243.66
• CAS Registry Number: 14345-96-1
• EINECS: 238-295-5
• SMILES: C2=C(C1=NOC(=C1C(=O)O)C)SC(=C2)Cl
• InChI: 1S/C9H6ClNO3S/c1-4-7(9(12)13)8(11-14-4)5-2-3-6(10)15-5/h2-3H,1H3,(H,12,13)
• InChIKey: WWFRJIAXONKBSK-UHFFFAOYSA-N

Properties

• Density: 1.514g/cm³ (Cal.)
• Boiling point: 386.157°C at 760 mmHg (Cal.)
• Flash point: 187.341°C (Cal.)