beta-(p-Chlorophenyl)phenethyl 4-(2-pyrimidyl)piperazinyl ketone

Base Information

• Chemical Name: beta-(p-Chlorophenyl)phenethyl 4-(2-pyrimidyl)piperazinyl ketone
• CAS No.: 33656-20-1
• Molecular Formula: C23H23 Cl N4 O
• Molecular Weight: 406.95
• DSSTox Substance ID: DTXSID30955276
• Nikkaji Number: J94.669I
• Mol file: 33656-20-1.mol

Synonyms:beta-(p-Chlorophenyl)phenethyl 4-(2-pyrimidyl)piperazinyl ketone;33656-20-1;3-(4-chlorophenyl)-3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one;1-(3-(p-Chlorophenyl)-3-phenylpropionyl)-4-(2-pyrimidyl)piperazine;KETONE, beta-(p-CHLOROPHENYL)PHENETHYL 4-(2-PYRIMIDYL)PIPERAZINYL;Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropionyl)-4-(2-pyrimidyl)-;C23H23ClN4O;DTXSID30955276;LS-87112;beta-(p-Chlorophenyl)phenethyl 4-(2-pyrimidinyl)-1-piperazinyl ketone;Piperazine, 1-(p-chloro-.beta.-phenylhydrocinnamoyl)-4-(2-pyrimidinyl)-;3-(4-chlorophenyl)-3-phenyl-1-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one

Chemical Property of beta-(p-Chlorophenyl)phenethyl 4-(2-pyrimidyl)piperazinyl ketone

Chemical Property:

• Vapor Pressure: 7.38E-16mmHg at 25°C
• Refractive Index: 1.5790 (estimate)
• Boiling Point: 631.6°C at 760 mmHg
• Flash Point: 335.8°C
• PSA: 49.33000
• Density: 1.257g/cm³
• LogP: 4.00370
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 406.1560391
• Heavy Atom Count: 29
• Complexity: 505

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1C2=NC=CC=N2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl