1-[4-(Chloromethanesulfonyl)-2-nitrophenyl]piperidine

Base Information

• Chemical Name: 1-[4-(Chloromethanesulfonyl)-2-nitrophenyl]piperidine
• CAS No.: 61496-65-9
• Molecular Formula: C12H15ClN2O4S
• DSSTox Substance ID: DTXSID40526239
• Wikidata: Q82394526

Synonyms:61496-65-9;1-[4-(Chloromethanesulfonyl)-2-nitrophenyl]piperidine;DTXSID40526239

Chemical Property of 1-[4-(Chloromethanesulfonyl)-2-nitrophenyl]piperidine

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 318.0441058
• Heavy Atom Count: 20
• Complexity: 439

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)CCl)[N+](=O)[O-]

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