1-(o-Tolyl)-4-(p-tolylsulphonyl)piperazine

Base Information

• Chemical Name: 1-(o-Tolyl)-4-(p-tolylsulphonyl)piperazine
• CAS No.: 83863-41-6
• Molecular Formula: C18H22 N2 O2 S
• Molecular Weight: 330.44448
• European Community (EC) Number: 281-104-5
• DSSTox Substance ID: DTXSID001003968
• Nikkaji Number: J326.925F
• Wikidata: Q82998725
• Mol file: 83863-41-6.mol

Synonyms:1-(o-Tolyl)-4-(p-tolylsulphonyl)piperazine;83863-41-6;EINECS 281-104-5;1-(2-methylphenyl)-4-(4-methylphenyl)sulfonylpiperazine;1-(2-methylphenyl)-4-[(4-methylphenyl)sulfonyl]piperazine;Oprea1_613241;DTXSID001003968;STK768718;AKOS001736662;1-(Toluene-4-sulfonyl)-4-O-tolyl-piperazine;SR-01000539407;1-(O-TOLYL)-4-(P-TOLYLSULFONYL)PIPERAZINE;SR-01000539407-1;1-(4-Methylbenzene-1-sulfonyl)-4-(2-methylphenyl)piperazine

Chemical Property of 1-(o-Tolyl)-4-(p-tolylsulphonyl)piperazine

Chemical Property:

• Vapor Pressure: 7.9E-10mmHg at 25°C
• Boiling Point: 492.1°C at 760 mmHg
• PKA: 5.54±0.40(Predicted)
• Flash Point: 251.4°C
• PSA: 49.00000
• Density: 1.212g/cm³
• LogP: 3.89800
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 330.14019912
• Heavy Atom Count: 23
• Complexity: 472

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3C