1-Benzyl-4-(2,4,4-trimethylallophanoyl)piperazine

Base Information

• Chemical Name: 1-Benzyl-4-(2,4,4-trimethylallophanoyl)piperazine
• CAS No.: 80712-46-5
• Molecular Formula: C16H24N4O2
• Molecular Weight: 304.39
• DSSTox Substance ID: DTXSID90230556
• Wikidata: Q83111149
• Mol file: 80712-46-5.mol

Synonyms:1-Benzyl-4-(2,4,4-trimethylallophanoyl)piperazine;80712-46-5;1-Piperazinecarboxamide, N-((dimethylamino)carbonyl)-N-methyl-4-(phenylmethyl)-;N-((Dimethylamino)carbonyl)-N-methyl-4-(phenylmethyl)-1-piperazinecarboxamide;DTXSID90230556;LS-110710

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

Chemical Property:

• Vapor Pressure: 8.51E-07mmHg at 25°C
• Melting Point: 95-97 °C
• Boiling Point: 405.8°C at 760 mmHg
• PKA: 6.51±0.10(Predicted)
• Flash Point: 160.8°C
• PSA: 47.10000
• Density: 1.173g/cm³
• LogP: 1.41340
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 304.18992602
• Heavy Atom Count: 22
• Complexity: 386

Purity/Quality:

1-BENZYL-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)CC2=CC=CC=C2