trans,trans-4'-Propylbicyclohexyl-4-yl 4-(trans-4-propylcyclohexyl)-benzoate

Base Information

• Chemical Name: trans,trans-4'-Propylbicyclohexyl-4-yl 4-(trans-4-propylcyclohexyl)-benzoate
• CAS No.: 86603-66-9
• Molecular Formula: C31H48O2
• Molecular Weight: 452.71
• DSSTox Substance ID: DTXSID80705243
• Mol file: 86603-66-9.mol

Synonyms:86603-66-9;trans,trans-4'-Propylbicyclohexyl-4-yl 4-(trans-4-propylcyclohexyl)-benzoate;SCHEMBL10902598;SCHEMBL14300378;DTXSID80705243;4'-Propyl[1,1'-bi(cyclohexane)]-4-yl 4-(4-propylcyclohexyl)benzoate

Chemical Property of trans,trans-4'-Propylbicyclohexyl-4-yl 4-(trans-4-propylcyclohexyl)-benzoate

Chemical Property:

• PSA: 26.30000
• LogP: 9.08260
• XLogP3: 11.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 452.365430770
• Heavy Atom Count: 33
• Complexity: 554

Purity/Quality:

98%Min ^*data from raw suppliers

TRANS,TRANS-4'-PROPYLBICYCLOHEXYL-4-YL 4-(TRANS-4-PROPYLCYCLOHEXYL)-BENZOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC=C(C=C3)C4CCC(CC4)CCC