1-(3-Chlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine

Base Information

• Chemical Name: 1-(3-Chlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine
• CAS No.: 80712-22-7
• Molecular Formula: C15H21ClN4O2
• Molecular Weight: 324.8058
• DSSTox Substance ID: DTXSID50230532
• Wikidata: Q83111114
• Mol file: 80712-22-7.mol

Synonyms:1-(3-Chlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine;80712-22-7;1-Piperazinecarboxamide, 4-(3-chlorophenyl)-N-((dimethylamino)carbonyl)-N-methyl-;4-(3-Chlorophenyl)-N-((dimethylamino)carbonyl)-N-methyl-1-piperazinecarboxamide;DTXSID50230532;LS-110665

Chemical Property of 1-(3-Chlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine

Chemical Property:

• Vapor Pressure: 1.87E-08mmHg at 25°C
• Melting Point: 95-96 °C
• Boiling Point: 454.7°Cat760mmHg
• PKA: 2.16±0.20(Predicted)
• Flash Point: 228.8°C
• PSA: 47.10000
• Density: 1.263g/cm³
• LogP: 2.19830
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 324.1353036
• Heavy Atom Count: 22
• Complexity: 410

Purity/Quality:

1-(3-CHLOROPHENYL)-4-(2,4,4-TRIMETHYLALLOPHANOYL)PIPERAZINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl