1-Phenyl-1,4-Dihydrothiochromeno[4,3-c]Pyrazole-3-Carboxylic Acid
[CAS# 69099-25-8]

Identification

• Name: 1-Phenyl-1,4-Dihydrothiochromeno[4,3-c]Pyrazole-3-Carboxylic Acid
• Synonyms: 1-Phenyl-1,4-Dihydrothiochromeno(4,3-C)Pyrazole-3-Carboxylic Acid; Nsc 320964; 1-Phenyl-1,4-Dihydrothiochromeno[4,3-C]Pyrazole-3-Carboxylic Acid
• Molecular Formula: C₁₇H₁₂N₂O₂S
• Molecular Weight: 308.35
• CAS Registry Number: 69099-25-8
• SMILES: C1=CC=CC4=C1C2=C(C(=N[N]2C3=CC=CC=C3)C(=O)O)CS4
• InChI: 1S/C17H12N2O2S/c20-17(21)15-13-10-22-14-9-5-4-8-12(14)16(13)19(18-15)11-6-2-1-3-7-11/h1-9H,10H2,(H,20,21)
• InChIKey: KGCPHZNGYDYXTL-UHFFFAOYSA-N

Properties

• Density: 1.422g/cm³ (Cal.)
• Boiling point: 576.524°C at 760 mmHg (Cal.)
• Flash point: 302.471°C (Cal.)