2-[(2,6-diisocyanatophenyl)methyl]-4-isocyanato-1-methyl-benzene
[CAS# 94213-36-2]

Identification

• Name: 2-[(2,6-diisocyanatophenyl)methyl]-4-isocyanato-1-methyl-benzene
• Synonyms: 2-[(5-isocyanato-2-methylphenyl)methyl]-m-phenylene diisocyanate
• Molecular Formula: C₁₇H₁₁N₃O₃
• Molecular Weight: 305.29
• CAS Registry Number: 94213-36-2
• EINECS: 303-740-5
• SMILES: O=C=Nc2cccc(N=C=O)c2Cc1cc(N=C=O)ccc1C
• InChI: 1S/C17H11N3O3/c1-12-5-6-14(18-9-21)7-13(12)8-15-16(19-10-22)3-2-4-17(15)20-11-23/h2-7H,8H2,1H3
• InChIKey: RYDGVOWJTFTKDR-UHFFFAOYSA-N

Properties

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