2-Isocyanato-4-[(4-isocyanatocyclohexyl)methyl]-1-methylcyclohexane

Base Information

• Chemical Name: 2-Isocyanato-4-[(4-isocyanatocyclohexyl)methyl]-1-methylcyclohexane
• CAS No.: 91458-02-5
• Molecular Formula: C16H24 N2 O2
• Molecular Weight: 276.37396
• European Community (EC) Number: 293-835-7
• DSSTox Substance ID: DTXSID50919714
• Nikkaji Number: J333.365E
• Mol file: 91458-02-5.mol

Synonyms:91458-02-5;EINECS 293-835-7;2-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]-1-methylcyclohexane;2-Isocyanato-4-((4-isocyanatocyclohexyl)methyl)-1-methylcyclohexane;SCHEMBL10507016;DTXSID50919714

Chemical Property of 2-Isocyanato-4-[(4-isocyanatocyclohexyl)methyl]-1-methylcyclohexane

Chemical Property:

• Vapor Pressure: 1E-05mmHg at 25°C
• Boiling Point: 371.8°Cat760mmHg
• Flash Point: 153.4°C
• PSA: 58.86000
• Density: 1.16g/cm³
• LogP: 3.41170
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 276.183778013
• Heavy Atom Count: 20
• Complexity: 403

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(CC1N=C=O)CC2CCC(CC2)N=C=O