2-(2-Hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one

Base Information

• Chemical Name: 2-(2-Hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one
• CAS No.: 54954-84-6
• Molecular Formula: C22H38N2O7
• Molecular Weight: 442.54632
• Mol file: 54954-84-6.mol

Synonyms:54954-84-6;(C12-H18-N2-O2.C6-H10-O2.C4-H10-O3)x-

Chemical Property of 2-(2-Hydroxyethoxy)ethanol;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane;oxepan-2-one

Chemical Property:

• PSA: 134.85000
• LogP: 2.33420
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 442.26790156
• Heavy Atom Count: 31
• Complexity: 467

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1CCC(=O)OCC1.C(COCCO)O