4-Oxo-4-phenylbutyl carbamimidothioate 4-methylbenzenesulfonate(1:1)

Base Information

• Chemical Name: 4-Oxo-4-phenylbutyl carbamimidothioate 4-methylbenzenesulfonate(1:1)
• CAS No.: 7248-90-0
• Molecular Formula: C18H22N2O4S2
• Molecular Weight: 394.5083
• NSC Number: 34538
• DSSTox Substance ID: DTXSID30283965

Synonyms:7248-90-0;4-oxo-4-phenylbutyl carbamimidothioate 4-methylbenzenesulfonate(1:1);NSC34538;DTXSID30283965;NSC-34538

Chemical Property of 4-Oxo-4-phenylbutyl carbamimidothioate 4-methylbenzenesulfonate(1:1)

Chemical Property:

• Vapor Pressure: 4.36E-06mmHg at 25°C
• Boiling Point: 383.6°Cat760mmHg
• Flash Point: 185.8°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 394.10209953
• Heavy Atom Count: 26
• Complexity: 431

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)O.C1=CC=C(C=C1)C(=O)CCCSC(=N)N

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