2-Chloro-1-nitro-4-(phenylsulfanyl)benzene

Base Information

• Chemical Name: 2-Chloro-1-nitro-4-(phenylsulfanyl)benzene
• CAS No.: 76320-14-4
• Molecular Formula: C12H8ClNO2S
• Molecular Weight: 265.71500
• DSSTox Substance ID: DTXSID90563775
• Wikidata: Q82448260

Synonyms:76320-14-4;2-Chloro-1-nitro-4-(phenylsulfanyl)benzene;SCHEMBL10786431;DTXSID90563775

Chemical Property of 2-Chloro-1-nitro-4-(phenylsulfanyl)benzene

Chemical Property:

• PSA: 71.12000
• LogP: 4.92260
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 264.9964274
• Heavy Atom Count: 17
• Complexity: 266

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])Cl

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