4-(trans-4-Methylcyclohexyl)cyclohexanone

Base Information

• Chemical Name: 4-(trans-4-Methylcyclohexyl)cyclohexanone
• CAS No.: 914221-47-9
• Molecular Formula: C₁₃H₂₂O
• Molecular Weight: 194.317
• European Community (EC) Number: 604-815-8
• DSSTox Substance ID: DTXSID60603899,DTXSID701275508
• Mol file: 914221-47-9.mol

Synonyms:151772-66-6;trans-4'-Methyl[1,1'-bicyclohexyl]-4-one;4-(trans-4-methylcyclohexyl)cyclohexanone;4-(4-methylcyclohexyl)cyclohexan-1-one;914221-47-9;trans-4'-Methyl-[1,1'-bi(cyclohexan)]-4-one;Trans-4-(Trans-4-methylcyclohexyl)cyclohexylanone;(1'R,4'R)-4'-METHYL-[1,1'-BI(CYCLOHEXANE)]-4-ONE;4'-Methylbi(cyclohexyl)-4-one;SCHEMBL10861500;SCHEMBL10861505;DTXSID60603899;RHUNWKYRWMYYMP-UHFFFAOYSA-N;DTXSID701275508;4-(4-methylcyclohexyl)cyclohexanone;BGA77266;AKOS006288119;AKOS030228380;BS-18930;4'-Methyl[1,1'-bi(cyclohexane)]-4-one;F16473;J-513879;trans-4a(2)-Methyl[1,1a(2)-bicyclohexyl]-4-one

Chemical Property of 4-(trans-4-Methylcyclohexyl)cyclohexanone

Chemical Property:

• PSA: 17.07000
• LogP: 3.57200
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 194.167065321
• Heavy Atom Count: 14
• Complexity: 191

Purity/Quality:

98% ^*data from raw suppliers

4'-METHYL-1,1'-BI(CYCLOHEXYL)-4-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(CC1)C2CCC(=O)CC2