Benzyl 3-Isobutyryloxy-1-Isopropyl-2,2-Dimethylpropyl Phthalate
[CAS# 16883-83-3]

Identification

• Name: Benzyl 3-Isobutyryloxy-1-Isopropyl-2,2-Dimethylpropyl Phthalate
• Synonyms: O1-[1-Isopropyl-2,2-Dimethyl-3-(2-Methylpropanoyloxy)Propyl] O2-(Phenylmethyl) Benzene-1,2-Dicarboxylate; Benzene-1,2-Dicarboxylic Acid O1-[1-Isopropyl-2,2-Dimethyl-3-(2-Methyl-1-Oxopropoxy)Propyl] O2-(Phenylmethyl) Ester; Benzene-1,2-Dicarboxylic Acid O2-(Benzyl) O1-(3-Isobutyryloxy-1-Isopropyl-2,2-Dimethyl-Propyl) Ester
• Molecular Formula: C₂₇H₃₄O₆
• Molecular Weight: 454.56
• CAS Registry Number: 16883-83-3
• EINECS: 240-920-1
• SMILES: C1=C(C(=CC=C1)C(=O)OC(C(COC(C(C)C)=O)(C)C)C(C)C)C(=O)OCC2=CC=CC=C2
• InChI: 1S/C27H34O6/c1-18(2)23(27(5,6)17-32-24(28)19(3)4)33-26(30)22-15-11-10-14-21(22)25(29)31-16-20-12-8-7-9-13-20/h7-15,18-19,23H,16-17H2,1-6H3
• InChIKey: HPZSSCRWFLKGOG-UHFFFAOYSA-N

Properties

• Density: 1.103g/cm³ (Cal.)
• Boiling point: 533.105°C at 760 mmHg (Cal.)
• Flash point: 225.011°C (Cal.)