3-[(4-Nitrobenzoyl)amino]benzenesulfonyl fluoride

Base Information

• Chemical Name: 3-[(4-Nitrobenzoyl)amino]benzenesulfonyl fluoride
• CAS No.: 19160-14-6
• Molecular Formula: C13H9FN2O5S
• Molecular Weight: 324.2844
• NSC Number: 113911
• DSSTox Substance ID: DTXSID80297077
• Nikkaji Number: J307.725J
• Wikidata: Q82038015
• Mol file: 19160-14-6.mol

Synonyms:3-[(4-nitrobenzoyl)amino]benzenesulfonyl fluoride;19160-14-6;3-(4-Nitrobenzamido)benzene-1-sulfonyl fluoride;NSC113911;starbld0019088;DTXSID80297077;NSC-113911

Chemical Property of 3-[(4-Nitrobenzoyl)amino]benzenesulfonyl fluoride

Chemical Property:

• Vapor Pressure: 3.3E-07mmHg at 25°C
• Boiling Point: 418.4°Cat760mmHg
• PKA: 11.17±0.70(Predicted)
• Flash Point: 206.8°C
• PSA: 117.44000
• Density: 1.537g/cm³
• LogP: 4.18230
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 324.02162073
• Heavy Atom Count: 22
• Complexity: 520

Purity/Quality:

99%+ ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)S(=O)(=O)F)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

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