Methyl 2,3-dichloro-5-nitrobenzoate

Base Information

• Chemical Name: Methyl 2,3-dichloro-5-nitrobenzoate
• CAS No.: 63105-54-4
• Molecular Formula: C8H5Cl2NO4
• Molecular Weight: 250.0356
• European Community (EC) Number: 263-859-2
• UNII: 5H3N9F1AIT
• DSSTox Substance ID: DTXSID5069671
• Nikkaji Number: J307.195B
• Wikidata: Q81996637

Synonyms:Methyl 2,3-dichloro-5-nitrobenzoate;63105-54-4;Benzoic acid, 2,3-dichloro-5-nitro-, methyl ester;5H3N9F1AIT;EINECS 263-859-2;methyl2,3-dichloro-5-nitrobenzoate;UNII-5H3N9F1AIT;DTXSID5069671;SCHEMBL22082614;CS-0237422;2,3-Dichloro-5-nitrobenzoic acid methyl ester;D96204;EN300-183315

Chemical Property of Methyl 2,3-dichloro-5-nitrobenzoate

Chemical Property:

• Vapor Pressure: 6.03E-05mmHg at 25°C
• Boiling Point: 345.7°C at 760 mmHg
• Flash Point: 162.9°C
• PSA: 72.12000
• Density: 1.533g/cm³
• LogP: 3.21140
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 248.9595630
• Heavy Atom Count: 15
• Complexity: 268

Purity/Quality:

99% ^*data from raw suppliers

Methyl2,3-dichloro-5-nitrobenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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