7-Chloro-3-phenyl-2-thioxo-1H-quinazolin-4-one
[CAS# 6736-96-5]

Identification

• Name: 7-Chloro-3-phenyl-2-thioxo-1H-quinazolin-4-one
• Synonyms: 7-Chloro-3-Phenyl-2-Thioxo-1H-Quinazolin-4-One; Zinc03316886; Oprea1_702587
• Molecular Formula: C₁₄H₉ClN₂OS
• Molecular Weight: 288.75
• CAS Registry Number: 6736-96-5
• SMILES: C3=C(N2C(C1=CC=C(C=C1NC2=S)Cl)=O)C=CC=C3
• InChI: 1S/C14H9ClN2OS/c15-9-6-7-11-12(8-9)16-14(19)17(13(11)18)10-4-2-1-3-5-10/h1-8H,(H,16,19)
• InChIKey: KPCPBBQBISDRFL-UHFFFAOYSA-N

Properties

• Density: 1.508g/cm³ (Cal.)
• Boiling point: 438.257°C at 760 mmHg (Cal.)
• Flash point: 218.85°C (Cal.)