1,4-Bis(isocyanatomethyl)cyclohexane

Base Information

• Chemical Name: 1,4-Bis(isocyanatomethyl)cyclohexane
• CAS No.: 10347-54-3
• Molecular Formula: C10H14 N2 O2
• Molecular Weight: 194.23036
• European Community (EC) Number: 233-757-2,825-609-6
• UN Number: 2206
• DSSTox Substance ID: DTXSID2065046,DTXSID601031501
• Nikkaji Number: J173.799F,J3.483.313C
• Mol file: 10347-54-3.mol

Synonyms:1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE;10347-54-3;EINECS 233-757-2;1,4-Bis(aminomethyl)cyclohexane diisocyanate;1,4-Cyclohexane bis(methylisocyanate);Cyclohexane, 1,4-bis(isocyanatomethyl)-;1,4-Bis(methylisocyanate)cyclohexane;1,4-Bis(methylisocyanate)cyclohexane [Diisocyanates];SCHEMBL44332;SCHEMBL1081546;SCHEMBL1081557;DTXSID2065046;1,4-diisocyanato methylcyclohexane;DTXSID601031501;AKOS006276843;1,4-bis-(isocyanato-methyl)-cyclohexane;cis-1,4-bis(isocyanatomethyl)cyclohexane;LS-56437;trans-1,4-bis(isocyanatomethyl)cyclohexane;1alpha,4beta-Bis(isocyanatomethyl)cyclohexane;Cyclohexane, 1,4-bis(isocyanatomethyl)-, trans-;98458-83-4

Chemical Property of 1,4-Bis(isocyanatomethyl)cyclohexane

Chemical Property:

• Vapor Pressure: 0.00162mmHg at 25°C
• Boiling Point: 294.4°Cat760mmHg
• Flash Point: 119.5°C
• PSA: 58.86000
• Density: 1.14g/cm³
• LogP: 1.46440
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 194.105527694
• Heavy Atom Count: 14
• Complexity: 229
• Transport DOT Label: Poison

Purity/Quality:

99.9% ^*data from raw suppliers

1,?4-?Bis(isocyanatomethyl?)?cyclohexane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(CCC1CN=C=O)CN=C=O
• Uses: 1,?4-?Bis(isocyanatomethyl?)?cyclohexane is a reagent used in the manufacture of poly/thiourethane- optical-based materials.Environmental toxin on US EPA Toxic Release Inventory list (TRI) list.