1-Dodecyl-2,4-diisocyanatobenzene
[CAS# 93859-04-2]

Identification

• Name: 1-Dodecyl-2,4-diisocyanatobenzene
• Synonyms: 6-dodecyl-1,3-phenylene diisocyanate
• Molecular Formula: C₂₀H₂₈N₂O₂
• Molecular Weight: 328.45
• CAS Registry Number: 93859-04-2
• EINECS: 299-339-7
• SMILES: O=C=N\c1ccc(CCCCCCCCCCCC)c(c1)\N=C=O
• InChI: 1S/C20H28N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-14-19(21-16-23)15-20(18)22-17-24/h13-15H,2-12H2,1H3
• InChIKey: GYNTWFAMMSEMNZ-UHFFFAOYSA-N

Properties

• Density: 0.998g/cm³ (Cal.)
• Boiling point: 433.8°C at 760 mmHg (Cal.)
• Flash point: 179.07°C (Cal.)