Chlorobenzene

Base Information

• Chemical Name: Chlorobenzene
• CAS No.: 68411-45-0
• Deprecated CAS: 50717-45-8
• Molecular Formula: C6H5Cl
• Molecular Weight: 112.5569
• European Community (EC) Number: 203-628-5,270-127-6
• ICSC Number: 0642
• NSC Number: 8433
• UN Number: 1134
• UNII: K18102WN1G
• DSSTox Substance ID: DTXSID4020298
• Nikkaji Number: J2.869J
• Wikipedia: Chlorobenzene
• Wikidata: Q407768
• Metabolomics Workbench ID: 49581
• ChEMBL ID: CHEMBL16200
• Mol file: 68411-45-0.mol

Synonyms:chlorobenzene;monochlorobenzene

Chemical Property of Chlorobenzene

Chemical Property:

• Boiling Point: 131.7°Cat760mmHg
• Flash Point: 23.9°C
• Density: 1.11g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 112.0079779
• Heavy Atom Count: 7
• Complexity: 46.1
• Transport DOT Label: Flammable Liquid

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Solvents -> Chlorinated Aromatics
• Canonical SMILES: C1=CC=C(C=C1)Cl
• Recent ClinicalTrials: To Evaluate the Effect of Chlorhexidine-benzidamine Administration
• Inhalation Risk: A harmful contamination of the air can be reached rather quickly on evaporation of this substance at 20 °C.
• Effects of Short Term Exposure: The substance is irritating to the eyes and skin. If this liquid is swallowed, aspiration into the lungs may result in chemical pneumonitis. The substance may cause effects on the central nervous system. This may result in lowering of consciousness.
• Effects of Long Term Exposure: The substance defats the skin, which may cause dryness or cracking. The substance may have effects on the liver and kidneys.