Ethylene (3-Isocyanatomethylphenyl)-Carbamate
[CAS# 68092-73-9]

Identification

• Name: Ethylene (3-Isocyanatomethylphenyl)-Carbamate
• Synonyms: N-[3-(Isocyanatomethyl)Phenyl]Carbamic Acid 2-[[[3-(Isocyanatomethyl)Phenyl]Amino]-Oxomethoxy]Ethyl Ester; N-[3-(Isocyanatomethyl)Phenyl]Carbamic Acid 2-[[3-(Isocyanatomethyl)Phenyl]Carbamoyloxy]Ethyl Ester; Carbamic Acid, (3-Isocyanatomethylphenyl)-, 1,2-Ethanediyl Ester
• Molecular Formula: C₂₀H₁₈N₄O₆
• Molecular Weight: 410.39
• CAS Registry Number: 68092-73-9
• EINECS: 268-471-7
• SMILES: O=C=NCC1=CC=CC(=C1)NC(=O)OCCOC(=O)NC2=CC=CC(=C2)CN=C=O
• InChI: 1S/C20H18N4O6/c25-13-21-11-15-3-1-5-17(9-15)23-19(27)29-7-8-30-20(28)24-18-6-2-4-16(10-18)12-22-14-26/h1-6,9-10H,7-8,11-12H2,(H,23,27)(H,24,28)
• InChIKey: XFIRHQKNSMDAHH-UHFFFAOYSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 517.035°C at 760 mmHg (Cal.)
• Flash point: 266.493°C (Cal.)