Cyclohexanecarboxylic acid, 4-butyl-, 4-cyanophenyl ester, trans-

Base Information

• Chemical Name: Cyclohexanecarboxylic acid, 4-butyl-, 4-cyanophenyl ester, trans-
• CAS No.: 62439-34-3
• Molecular Formula: C18H23 N O2
• Molecular Weight: 285.38
• DSSTox Substance ID: DTXSID70886171
• Nikkaji Number: J149.499F,J2.193.545J
• Mol file: 62439-34-3.mol

Synonyms:62439-34-3;Cyclohexanecarboxylic acid, 4-butyl-, 4-cyanophenyl ester, trans-;trans-4-Butylcyclohexanecarboxylic acid, 4-cyanophenyl ester;4-Cyanophenyl 4-butylcyclohexanecarboxylate;Oprea1_055913;SCHEMBL3282334;SCHEMBL11159668;DTXSID70886171;LCDCOOLHWJZOQR-KOMQPUFPSA-N;AKOS002793935;4-Cyanophenyl 4-butylcyclohexanecarboxylate #;(4-Cyanophenyl)4-butylcyclohexane-1-carboxylate

Chemical Property of Cyclohexanecarboxylic acid, 4-butyl-, 4-cyanophenyl ester, trans-

Chemical Property:

• Vapor Pressure: 3.55E-07mmHg at 25°C
• Boiling Point: 417.4°C at 760 mmHg
• Flash Point: 205°C
• PSA: 50.09000
• Density: 1.07g/cm³
• LogP: 4.46028
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 285.172878976
• Heavy Atom Count: 21
• Complexity: 368

Purity/Quality:

99.0%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C#N