1-[(2,6-diisocyanatophenyl)methyl]-3-isocyanato-2-methyl-benzene
[CAS# 94213-38-4]

Identification

• Name: 1-[(2,6-diisocyanatophenyl)methyl]-3-isocyanato-2-methyl-benzene
• Synonyms: 2-[(3-isocyanato-2-methylphenyl)methyl]-m-phenylene diisocyanate
• Molecular Formula: C₁₇H₁₁N₃O₃
• Molecular Weight: 305.29
• CAS Registry Number: 94213-38-4
• EINECS: 303-742-6
• SMILES: O=C=Nc2cccc(N=C=O)c2Cc1cccc(N=C=O)c1C
• InChI: 1S/C17H11N3O3/c1-12-13(4-2-5-15(12)18-9-21)8-14-16(19-10-22)6-3-7-17(14)20-11-23/h2-7H,8H2,1H3
• InChIKey: UXSDGXOKNGHNEL-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)
• Boiling point: 455.206°C at 760 mmHg (Cal.)
• Flash point: 187.684°C (Cal.)