3-(4-Acetylphenyl)-6-Chloro-2,3-Dihydro-2-Thioxoquinazolin-4(1H)-One
[CAS# 64046-69-1]

Identification

• Name: 3-(4-Acetylphenyl)-6-Chloro-2,3-Dihydro-2-Thioxoquinazolin-4(1H)-One
• Synonyms: 3-(4-Acetylphenyl)-6-Chloro-2-Thioxo-1H-Quinazolin-4-One; 6-Chloro-3-(4-Ethanoylphenyl)-2-Sulfanylidene-1H-Quinazolin-4-One; 4(1H)-Quinazolinone, 2,3,-Dihydro-3-(4-Acetylphenyl)-6-Chloro-2-Thioxo-
• Molecular Formula: C₁₆H₁₁ClN₂O₂S
• Molecular Weight: 330.79
• CAS Registry Number: 64046-69-1
• SMILES: C1=C(C=C2C(=C1)NC(N(C2=O)C3=CC=C(C=C3)C(C)=O)=S)Cl
• InChI: 1S/C16H11ClN2O2S/c1-9(20)10-2-5-12(6-3-10)19-15(21)13-8-11(17)4-7-14(13)18-16(19)22/h2-8H,1H3,(H,18,22)
• InChIKey: JBIWDJKXOKDMJR-UHFFFAOYSA-N

Properties

• Density: 1.501g/cm³ (Cal.)
• Boiling point: 532.171°C at 760 mmHg (Cal.)
• Flash point: 275.647°C (Cal.)