Diphenyl carbonate;hexane-1,6-diol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one

Base Information

• Chemical Name: Diphenyl carbonate;hexane-1,6-diol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one
• CAS No.: 87836-98-4
• Molecular Formula: C37H52N2O9
• Molecular Weight: 668.81678
• Mol file: 87836-98-4.mol

Synonyms:87836-98-4;(C13-H10-O3.C12-H18-N2-O2.C6-H14-O2.C6-H10-O2)x-

Chemical Property of Diphenyl carbonate;hexane-1,6-diol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one

Chemical Property:

• Vapor Pressure: 0.00257mmHg at 25°C
• Boiling Point: 286.9°C at 760 mmHg
• Flash Point: 116°C
• PSA: 161.15000
• LogP: 7.14240
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 12
• Exact Mass: 668.36728124
• Heavy Atom Count: 48
• Complexity: 665

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1CCC(=O)OCC1.C1=CC=C(C=C1)OC(=O)OC2=CC=CC=C2.C(CCCO)CCO

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