Dibenzyl 5-Aminoisophthalate
[CAS# 152699-63-3]

Identification

• Name: Dibenzyl 5-Aminoisophthalate
• Synonyms: 1,3-Benzenedicarboxylicacid,5-amino-,1,3-bis(phenylmethyl)ester; 5-Aminobenzene-1,3-dicarboxylic acid dibenzyl ester; 5-Aminoisophthalic acid dibenzyl ester
• Molecular Formula: C₂₂H₁₉NO₄
• Molecular Weight: 361.39
• CAS Registry Number: 152699-63-3
• SMILES: C1=CC=C(C=C1)COC(=O)C2=CC(=CC(=C2)N)C(=O)OCC3=CC=CC=C3
• InChI: 1S/C22H19NO4/c23-20-12-18(21(24)26-14-16-7-3-1-4-8-16)11-19(13-20)22(25)27-15-17-9-5-2-6-10-17/h1-13H,14-15,23H2
• InChIKey: VDJWRMQQXQBYIO-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 116-118°C (Expl.)
• Boiling point: 561.3±40.0°C at 760 mmHg (Cal.)
• Flash point: 233.1±23.7°C (Cal.)
• Refractive index: 1.632 (Cal.)