Amflutizole
[CAS# 82114-19-0]

Identification

• Name: Amflutizole
• Synonyms: 4-Amino-3-[3-(Trifluoromethyl)Phenyl]Isothiazole-5-Carboxylic Acid; 4-Amino-3-[3-(Trifluoromethyl)Phenyl]-5-Isothiazolecarboxylic Acid; 4-Amino-3-(3-(Trifluoromethyl)Phenyl)-5-Isothiazolecarboxylic Acid
• Molecular Formula: C₁₁H₇F₃N₂O₂S
• Molecular Weight: 288.24
• CAS Registry Number: 82114-19-0
• SMILES: C1=C(C=CC=C1C2=NSC(=C2N)C(O)=O)C(F)(F)F
• InChI: 1S/C11H7F3N2O2S/c12-11(13,14)6-3-1-2-5(4-6)8-7(15)9(10(17)18)19-16-8/h1-4H,15H2,(H,17,18)
• InChIKey: KVMCEGAWQYTFKC-UHFFFAOYSA-N

Properties

• Density: 1.552g/cm³ (Cal.)
• Boiling point: 332.643°C at 760 mmHg (Cal.)
• Flash point: 154.977°C (Cal.)