2-Ethylhexyl (3-Isocyanatomethylphenyl)-Carbamate
[CAS# 54634-94-5]

Identification

• Name: 2-Ethylhexyl (3-Isocyanatomethylphenyl)-Carbamate
• Synonyms: N-[3-(Isocyanatomethyl)Phenyl]Carbamic Acid 2-Ethylhexyl Ester; (3-Isocyanatomethylphenyl)Carbamic Acid, 2-Ethylhexyl Ester; 2-Ethylhexyl (3-Isocyanatomethylphenyl)-Carbamate
• Molecular Formula: C₁₇H₂₄N₂O₃
• Molecular Weight: 304.39
• CAS Registry Number: 54634-94-5
• EINECS: 259-265-8
• SMILES: O=C=NCC1=CC=CC(=C1)NC(=O)OCC(CCCC)CC
• InChI: 1S/C17H24N2O3/c1-3-5-7-14(4-2)12-22-17(21)19-16-9-6-8-15(10-16)11-18-13-20/h6,8-10,14H,3-5,7,11-12H2,1-2H3,(H,19,21)
• InChIKey: HZXOAHQYDYYYQI-UHFFFAOYSA-N

Properties

• Density: 1.062g/cm³ (Cal.)
• Boiling point: 382.916°C at 760 mmHg (Cal.)
• Flash point: 185.381°C (Cal.)