Isophorone diisocyanate, trimethylolpropane, 1,3-butylene glycol polymer
[CAS# 30228-07-0]

Identification

• Name: Isophorone diisocyanate, trimethylolpropane, 1,3-butylene glycol polymer
• Synonyms: Butane-1,3-Diol; 2-Ethyl-2-(Hydroxymethyl)Propane-1,3-Diol; 5-Isocyanato-1-(Isocyanatomethyl)-1,3,3-Trimethyl-Cyclohexane; Butane-1,3-Diol; 2-Ethyl-2-Methylol-Propane-1,3-Diol; 5-Isocyanato-1-(Isocyanatomethyl)-1,3,3-Trimethyl-Cyclohexane
• Molecular Formula: C₂₂H₄₂N₂O₇
• Molecular Weight: 446.58
• CAS Registry Number: 30228-07-0
• SMILES: N(CC1(CC(CC(C1)N=C=O)(C)C)C)=C=O.C(CC(C)O)O.C(C(CO)(CO)CC)O
• InChI: 1S/C12H18N2O2.C6H14O3.C4H10O2/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;1-4(6)2-3-5/h10H,4-7H2,1-3H3;7-9H,2-5H2,1H3;4-6H,2-3H2,1H3
• InChIKey: UWGDAQQJCTWIBA-UHFFFAOYSA-N

Properties

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