1,3-Bis((phenylsulphonyl)methyl)urea

Base Information

• Chemical Name: 1,3-Bis((phenylsulphonyl)methyl)urea
• CAS No.: 76965-49-6
• Molecular Formula: C15H16N2O5S2
• Molecular Weight: 368.42794
• European Community (EC) Number: 278-582-2
• DSSTox Substance ID: DTXSID50998241
• Nikkaji Number: J309.338G
• Wikidata: Q82990768
• Mol file: 76965-49-6.mol

Synonyms:76965-49-6;EINECS 278-582-2;1,3-Bis((phenylsulphonyl)methyl)urea;1,3-bis[(phenylsulphonyl)methyl]urea;1,3-BIS[(PHENYLSULFONYL)METHYL]UREA;SCHEMBL11306682;DTXSID50998241;N,N'-Bis[(phenylsulfonyl)methyl]urea;N,N'-Bis[(benzenesulfonyl)methyl]carbamimidic acid

Chemical Property of 1,3-Bis((phenylsulphonyl)methyl)urea

Chemical Property:

• Vapor Pressure: 1.3E-20mmHg at 25°C
• Refractive Index: 1.597
• Boiling Point: 720.5 °C at 760 mmHg
• Flash Point: 389.6 °C
• PSA: 129.66000
• Density: 1.389 g/cm³
• LogP: 3.90530
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 368.05006396
• Heavy Atom Count: 24
• Complexity: 553

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)CNC(=O)NCS(=O)(=O)C2=CC=CC=C2