Methylenedi-4,1-Cyclohexyleneisocyanate, 5-Amino-1,3,3-Trimethylcyclohexanemethanamine, 2-Oxepanone Polymer
[CAS# 67599-31-9]

Identification

• Name: Methylenedi-4,1-Cyclohexyleneisocyanate, 5-Amino-1,3,3-Trimethylcyclohexanemethanamine, 2-Oxepanone Polymer
• Synonyms: 3-(Aminomethyl)-3,5,5-Trimethyl-Cyclohexan-1-Amine; 1-Isocyanato-4-[(4-Isocyanatocyclohexyl)Methyl]Cyclohexane; Oxepan-2-One; 3-(Aminomethyl)-3,5,5-Trimethyl-1-Cyclohexanamine; 1-Isocyanato-4-[(4-Isocyanatocyclohexyl)Methyl]Cyclohexane; 2-Oxepanone
• Molecular Formula: C₃₁H₅₄N₄O₄
• Molecular Weight: 546.79
• CAS Registry Number: 67599-31-9
• SMILES: O=C=NC2CCC(CC1CCC(N=C=O)CC1)CC2.C3C(OCCCC3)=O.C(N)C4(CC(CC(N)C4)(C)C)C
• InChI: 1S/C15H22N2O2.C10H22N2.C6H10O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;1-9(2)4-8(12)5-10(3,6-9)7-11;7-6-4-2-1-3-5-8-6/h12-15H,1-9H2;8H,4-7,11-12H2,1-3H3;1-5H2
• InChIKey: JXOUEHYHBZRCQK-UHFFFAOYSA-N

Properties

• Boiling point: 363.4°C at 760 mmHg (Cal.)
• Flash point: 149.8°C (Cal.)