2-(Acetyloxy)-Benzoic Acid (4-(4,4-Dimethyl-3-Oxopentyl)-3,5-Dioxo- 1,2-Diphenyl-4-Pyrazolidinyl)Methyl Ester
[CAS# 43213-37-2]

Identification

• Name: 2-(Acetyloxy)-Benzoic Acid (4-(4,4-Dimethyl-3-Oxopentyl)-3,5-Dioxo- 1,2-Diphenyl-4-Pyrazolidinyl)Methyl Ester
• Synonyms: [4-(4,4-Dimethyl-3-Oxo-Pentyl)-3,5-Dioxo-1,2-Di(Phenyl)Pyrazolidin-4-Yl]Methyl 2-Acetoxybenzoate; 2-Acetoxybenzoic Acid [4-(4,4-Dimethyl-3-Oxopentyl)-3,5-Dioxo-1,2-Di(Phenyl)-4-Pyrazolidinyl]Methyl Ester; 2-Acetoxybenzoic Acid [3,5-Diketo-4-(3-Keto-4,4-Dimethyl-Pentyl)-1,2-Di(Phenyl)Pyrazolidin-4-Yl]Methyl Ester
• Molecular Formula: C₃₂H₃₂N₂O₇
• Molecular Weight: 556.61
• CAS Registry Number: 43213-37-2
• SMILES: C1=C(C(=CC=C1)C(=O)OCC2(C(N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)=O)CCC(C(C)(C)C)=O)OC(=O)C
• InChI: 1S/C32H32N2O7/c1-22(35)41-26-18-12-11-17-25(26)28(37)40-21-32(20-19-27(36)31(2,3)4)29(38)33(23-13-7-5-8-14-23)34(30(32)39)24-15-9-6-10-16-24/h5-18H,19-21H2,1-4H3
• InChIKey: UNVVZOLRNIAUMD-UHFFFAOYSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 647.577°C at 760 mmHg (Cal.)
• Flash point: 345.442°C (Cal.)