4-(2-Chloro-Acetyl)-1,5-Dimethyl-2-Phenyl-1,2-Dihydro-Pyrazol-3-One
[CAS# 6630-73-5]

Identification

• Name: 4-(2-Chloro-Acetyl)-1,5-Dimethyl-2-Phenyl-1,2-Dihydro-Pyrazol-3-One
• Synonyms: 4-(2-Chloroacetyl)-1,5-Dimethyl-2-Phenyl-Pyrazol-3-One; 4-(2-Chloro-1-Oxoethyl)-1,5-Dimethyl-2-Phenyl-3-Pyrazolone; 4-(2-Chloroethanoyl)-1,5-Dimethyl-2-Phenyl-Pyrazol-3-One
• Molecular Formula: C₁₃H₁₃ClN₂O₂
• Molecular Weight: 264.71
• CAS Registry Number: 6630-73-5
• SMILES: C1=CC=CC=C1N2C(C(=C(N2C)C)C(CCl)=O)=O
• InChI: 1S/C13H13ClN2O2/c1-9-12(11(17)8-14)13(18)16(15(9)2)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
• InChIKey: QGWUTAPXLRKROO-UHFFFAOYSA-N

Properties

• Density: 1.301g/cm³ (Cal.)
• Boiling point: 379.661°C at 760 mmHg (Cal.)
• Flash point: 183.413°C (Cal.)