Feclobuzone
[CAS# 23111-34-4]

Identification

• Name: Feclobuzone
• Synonyms: 4-Chlorobenzoic Acid [4-Butyl-3,5-Dioxo-1,2-Di(Phenyl)-4-Pyrazolidinyl]Methyl Ester; 4-Chlorobenzoic Acid [4-Butyl-3,5-Diketo-1,2-Di(Phenyl)Pyrazolidin-4-Yl]Methyl Ester; (4-Butyl-3,5-Diphenyl-4-Pyrazolidinyl)Methyl 4-Chlorbenzoat
• Molecular Formula: C₂₇H₂₅ClN₂O₄
• Molecular Weight: 476.96
• CAS Registry Number: 23111-34-4
• SMILES: C1=CC=CC=C1N2C(C(C(N2C3=CC=CC=C3)=O)(COC(C4=CC=C(Cl)C=C4)=O)CCCC)=O
• InChI: 1S/C27H25ClN2O4/c1-2-3-18-27(19-34-24(31)20-14-16-21(28)17-15-20)25(32)29(22-10-6-4-7-11-22)30(26(27)33)23-12-8-5-9-13-23/h4-17H,2-3,18-19H2,1H3
• InChIKey: OZKQTMYKYQGCME-UHFFFAOYSA-N

Properties

• Density: 1.267g/cm³ (Cal.)
• Boiling point: 578.265°C at 760 mmHg (Cal.)
• Flash point: 303.524°C (Cal.)