Cas no 3463-43-2 (1,4-Dichloro-2,5-dimethyl-3-nitrobenzene)

1,4-Dichloro-2,5-dimethyl-3-nitrobenzene structure
3463-43-2 structure
Product Name:1,4-Dichloro-2,5-dimethyl-3-nitrobenzene
CAS No:3463-43-2
MF:C8H7Cl2NO2
MW:220.052680253983
CID:1090227
PubChem ID:20456617
Update Time:2025-04-20

1,4-Dichloro-2,5-dimethyl-3-nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 1,4-Dichloro-2,5-dimethyl-3-nitrobenzene
    • DTXSID40607411
    • 3463-43-2
    • SCHEMBL11029357
    • DA-06593
    • Inchi: 1S/C8H7Cl2NO2/c1-4-3-6(9)5(2)8(7(4)10)11(12)13/h3H,1-2H3
    • InChI Key: BGBKSOLUHNXPOJ-UHFFFAOYSA-N
    • SMILES: ClC1=C(C)C=C(C(C)=C1[N+](=O)[O-])Cl

Computed Properties

  • Exact Mass: 218.98551
  • Monoisotopic Mass: 218.9853839g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 207
  • 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: 3.7
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • PSA: 43.14

1,4-Dichloro-2,5-dimethyl-3-nitrobenzene Pricemore >>

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