4-[4-(4-Ethylcyclohexyl)cyclohexyl]benzonitrile

Base Information

• Chemical Name: 4-[4-(4-Ethylcyclohexyl)cyclohexyl]benzonitrile
• CAS No.: 89409-90-5
• Molecular Formula: C21H29 N
• Molecular Weight: 295.46
• DSSTox Substance ID: DTXSID901176746
• Nikkaji Number: J472.972B
• Mol file: 89409-90-5.mol

Synonyms:89409-90-5;SCHEMBL7511065;SCHEMBL8045660;SCHEMBL8045664;SCHEMBL8045673;JPWFWALAPSXMKY-JEKGWRKSSA-N;JPWFWALAPSXMKY-UHFFFAOYSA-N;DTXSID901176746;4-[(trans,trans)-4'-Ethyl[1,1'-bicyclohexyl]-4-yl]benzonitrile

Chemical Property of 4-[4-(4-Ethylcyclohexyl)cyclohexyl]benzonitrile

Chemical Property:

• PSA: 23.79000
• LogP: 6.04848
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 295.229999929
• Heavy Atom Count: 22
• Complexity: 368

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)C#N