Chlorophenyl 2-nitrobenzenesulphonate

Base Information

• Chemical Name: Chlorophenyl 2-nitrobenzenesulphonate
• CAS No.: 94088-67-2
• Molecular Formula: C12H8 Cl N O5 S
• Molecular Weight: 313.71362
• European Community (EC) Number: 302-069-5
• DSSTox Substance ID: DTXSID20916518
• Nikkaji Number: J62.907C
• Mol file: 94088-67-2.mol

Synonyms:94088-67-2;Chlorophenyl 2-nitrobenzenesulphonate;(2-chlorophenyl) 2-nitrobenzenesulfonate;CHLOROPHENYL 2-NITROBENZENESULFONATE;C12-H8-Cl-N-O5-S;DTXSID20916518;EINECS 302-069-5;AKOS040695491;2-Chlorophenyl 2-nitrobenzene-1-sulfonate;2-Nitrobenzenesulfonic acid 2-chlorophenyl ester

Chemical Property of Chlorophenyl 2-nitrobenzenesulphonate

Chemical Property:

• Vapor Pressure: 4.21E-09mmHg at 25°C
• Boiling Point: 485.3°Cat760mmHg
• Flash Point: 247.3°C
• PSA: 97.57000
• Density: 1.516g/cm³
• LogP: 4.61990
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 312.9811712
• Heavy Atom Count: 20
• Complexity: 444

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=CC=C2Cl

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