[4-(4-Methylbenzene-1-sulfonyl)piperazin-1-yl](4-nitrophenyl)methanone

Base Information

• Chemical Name: [4-(4-Methylbenzene-1-sulfonyl)piperazin-1-yl](4-nitrophenyl)methanone
• CAS No.: 5937-81-5
• Molecular Formula: C18H19N3O5S
• Molecular Weight: 389.4256
• DSSTox Substance ID: DTXSID90360746
• Wikidata: Q82142648

Synonyms:5937-81-5;CBMicro_049515;Oprea1_454771;Oprea1_639359;SCHEMBL752270;DTXSID90360746;STK128928;AKOS000553102;BIM-0049475.P001;[4-(4-Methylbenzene-1-sulfonyl)piperazin-1-yl](4-nitrophenyl)methanone;{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}(4-nitrophenyl)methanone;{4-[(4-METHYLPHENYL)SULFONYL]PIPERAZINO}(4-NITROPHENYL)METHANONE

Chemical Property of [4-(4-Methylbenzene-1-sulfonyl)piperazin-1-yl](4-nitrophenyl)methanone

Chemical Property:

• Vapor Pressure: 7.73E-15mmHg at 25°C
• Boiling Point: 610.3°Cat760mmHg
• Flash Point: 322.9°C
• Density: 1.386g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 389.10454189
• Heavy Atom Count: 27
• Complexity: 633

Purity/Quality:

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)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

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