1-{[(4-Chlorophenyl)methyl]amino}cyclohexane-1-carboxylic acid

Base Information

• Chemical Name: 1-{[(4-Chlorophenyl)methyl]amino}cyclohexane-1-carboxylic acid
• CAS No.: 939760-89-1
• Molecular Formula: C14H19Cl2NO2
• Molecular Weight: 304.21216
• DSSTox Substance ID: DTXSID20585581
• Mol file: 939760-89-1.mol

Synonyms:939760-89-1;1-{[(4-Chlorophenyl)methyl]amino}cyclohexane-1-carboxylic acid;1-[(4-chlorophenyl)methylamino]cyclohexane-1-carboxylic acid;DTXSID20585581

Chemical Property of 1-{[(4-Chlorophenyl)methyl]amino}cyclohexane-1-carboxylic acid

Chemical Property:

• PSA: 49.33000
• LogP: 4.41000
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 267.1026065
• Heavy Atom Count: 18
• Complexity: 282

Purity/Quality:

95%-98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C(=O)O)NCC2=CC=C(C=C2)Cl