1-{2,2-Bis[(4-Isocyanatophenoxy)Methyl]Butoxy}-4-Isocyanatobenzene
[CAS# 121514-80-5]

Identification

• Name: 1-{2,2-Bis[(4-Isocyanatophenoxy)Methyl]Butoxy}-4-Isocyanatobenzene
• Molecular Formula: C₂₇H₂₃N₃O₆
• Molecular Weight: 485.49
• CAS Registry Number: 121514-80-5
• SMILES: O=C=N/c1ccc(cc1)OCC(COc2ccc(cc2)/N=C=O)(CC)COc3ccc(/N=C=O)cc3
• InChI: 1S/C27H23N3O6/c1-2-27(15-34-24-9-3-21(4-10-24)28-18-31,16-35-25-11-5-22(6-12-25)29-19-32)17-36-26-13-7-23(8-14-26)30-20-33/h3-14H,2,15-17H2,1H3
• InChIKey: XGTXSOCSVDGFNG-UHFFFAOYSA-N

Properties

• Density: 1.181g/cm³ (Cal.)
• Boiling point: 610.655°C at 760 mmHg (Cal.)
• Flash point: 213.518°C (Cal.)
• Refractive index: 1.573 (Cal.)