Phthalic Acid 1-(2-Methylbutyl)2-(Phenylmethyl) Ester
[CAS# 71463-82-6]

Identification

• Name: Phthalic Acid 1-(2-Methylbutyl)2-(Phenylmethyl) Ester
• Synonyms: Benzene-1,2-Dicarboxylic Acid O1-[(2R)-2-Methylbutyl] O2-(Phenylmethyl) Ester; Benzene-1,2-Dicarboxylic Acid O2-(Benzyl) O1-[(2R)-2-Methylbutyl] Ester; 1,2-Benzenedicarboxylic Acid, 2-Methylbutyl Phenylmethyl Ester
• Molecular Formula: C₂₀H₂₂O₄
• Molecular Weight: 326.39
• CAS Registry Number: 71463-82-6
• SMILES: [C@H](COC(C2=C(C(OCC1=CC=CC=C1)=O)C=CC=C2)=O)(CC)C
• InChI: 1S/C20H22O4/c1-3-15(2)13-23-19(21)17-11-7-8-12-18(17)20(22)24-14-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3/t15-/m1/s1
• InChIKey: ZRYUYMRIBIOSBD-OAHLLOKOSA-N

Properties

• Density: 1.117g/cm³ (Cal.)
• Boiling point: 416.938°C at 760 mmHg (Cal.)
• Flash point: 201.444°C (Cal.)