2-Oxepanone, Polymer With 2-Ethyl-2-(Hydroxymethyl)-1,3-Propanediol And 5-Isocyanato-1-(Isocyanatomethyl) -1,3,3-Trimethylcyclohexane, Isocyanate-Terminated
[CAS# 68954-65-4]

Identification

• Name: 2-Oxepanone, Polymer With 2-Ethyl-2-(Hydroxymethyl)-1,3-Propanediol And 5-Isocyanato-1-(Isocyanatomethyl) -1,3,3-Trimethylcyclohexane, Isocyanate-Terminated
• Synonyms: 2-Ethyl-2-(Hydroxymethyl)Propane-1,3-Diol; 5-Isocyanato-1-(Isocyanatomethyl)-1,3,3-Trimethyl-Cyclohexane; Oxepan-2-One; 2-Ethyl-2-(Hydroxymethyl)Propane-1,3-Diol; 5-Isocyanato-1-(Isocyanatomethyl)-1,3,3-Trimethylcyclohexane; 2-Oxepanone
• Molecular Formula: C₂₄H₄₂N₂O₇
• Molecular Weight: 470.61
• CAS Registry Number: 68954-65-4 (55636-48-1)
• SMILES: O=C=NC1CC(CC(C1)(C)C)(CN=C=O)C.C(O)C(CO)(CO)CC.C2C(OCCCC2)=O
• InChI: 1S/C12H18N2O2.C6H14O3.C6H10O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15;1-2-6(3-7,4-8)5-9;7-6-4-2-1-3-5-8-6/h10H,4-7H2,1-3H3;7-9H,2-5H2,1H3;1-5H2
• InChIKey: JVCHXKLLOOOFJT-UHFFFAOYSA-N

Properties

• Boiling point: 286.9°C at 760 mmHg (Cal.)
• Flash point: 116°C (Cal.)