4-[(2,6-diisocyanatophenyl)methyl]-2-isocyanato-1-methyl-benzene
[CAS# 94213-37-3]

Identification

• Name: 4-[(2,6-diisocyanatophenyl)methyl]-2-isocyanato-1-methyl-benzene
• Synonyms: 2-[(3-isocyanato-4-methylphenyl)methyl]-m-phenylene diisocyanate
• Molecular Formula: C₁₇H₁₁N₃O₃
• Molecular Weight: 305.29
• CAS Registry Number: 94213-37-3
• EINECS: 303-741-0
• SMILES: O=C=Nc2cccc(N=C=O)c2Cc1ccc(C)c(N=C=O)c1
• InChI: 1S/C17H11N3O3/c1-12-5-6-13(8-17(12)20-11-23)7-14-15(18-9-21)3-2-4-16(14)19-10-22/h2-6,8H,7H2,1H3
• InChIKey: PJXWOMTVMBIZAQ-UHFFFAOYSA-N

Properties

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