Cas no 112170-45-3 (2,6-dichloro-3-[(2-methyl-4-nitrophenyl)methyl]pyridine)

2,6-dichloro-3-[(2-methyl-4-nitrophenyl)methyl]pyridine structure
112170-45-3 structure
Product Name:2,6-dichloro-3-[(2-methyl-4-nitrophenyl)methyl]pyridine
CAS No:112170-45-3
MF:C13H10Cl2N2O2
MW:297.136701107025
CID:2608222
PubChem ID:13924584
Update Time:2025-04-21

2,6-dichloro-3-[(2-methyl-4-nitrophenyl)methyl]pyridine Chemical and Physical Properties

Names and Identifiers

    • 2,6-dichloro-3-[(2-methyl-4-nitrophenyl)methyl]pyridine
    • 112170-45-3
    • DTXSID80552552
    • Inchi: 1S/C13H10Cl2N2O2/c1-8-6-11(17(18)19)4-2-9(8)7-10-3-5-12(14)16-13(10)15/h2-6H,7H2,1H3
    • InChI Key: UMUDXSLYEWABCQ-UHFFFAOYSA-N
    • SMILES: ClC1C(=CC=C(N=1)Cl)CC1C=CC(=CC=1C)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 296.0119330Da
  • Monoisotopic Mass: 296.0119330Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 324
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.9
  • Topological Polar Surface Area: 58.7?2
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