N-t-butyl 3-nitrobenzenesulfonamide

Base Information

• Chemical Name: N-t-butyl 3-nitrobenzenesulfonamide
• CAS No.: 424818-25-7
• Molecular Formula: C10H14N2O4S
• Molecular Weight: 258.29
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID20387305
• Mol file: 424818-25-7.mol

Synonyms:N-t-butyl 3-nitrobenzenesulfonamide;424818-25-7;N-tert-butyl-3-nitrobenzenesulfonamide;N-(TERT-BUTYL)-3-NITROBENZENESULFONAMIDE;N-tert-butyl 3-nitrobenzenesulfonamide;N-T-BUTYL3-NITROBENZENESULFONAMIDE;Cambridge id 6109694;SCHEMBL18739981;AMY7176;DTXSID20387305;N-t-butyl-3-nitrobenzenesulfonamide;MFCD01985492;STK203795;AKOS001103148;AB10598;AS-62205;CS-0199129;FT-0763399;A50708;A872878;N-TERT-BUTYL-3-NITROBENZENE-1-SULFONAMIDE;SR-01000227917;SR-01000227917-1;Z45516692

Chemical Property of N-t-butyl 3-nitrobenzenesulfonamide

Chemical Property:

• Boiling Point: 385.7 °C at 760 mmHg
• PKA: 10.98±0.50(Predicted)
• Flash Point: 187.1 °C
• PSA: 100.37000
• Density: 1.282 g/cm³
• LogP: 3.66650
• Storage Temp.: Room Temperature, under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 258.06742811
• Heavy Atom Count: 17
• Complexity: 375

Purity/Quality:

98%min ^*data from raw suppliers

N-tert-Butyl3-Nitrobenzenesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)NS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-]