Cas no 62366-69-2 (1,2-Benzenedicarbonyl dichloride, 4-methoxy-)

1,2-Benzenedicarbonyl dichloride, 4-methoxy- structure
62366-69-2 structure
Product Name:1,2-Benzenedicarbonyl dichloride, 4-methoxy-
CAS No:62366-69-2
MF:C9H6Cl2O3
MW:233.048141002655
CID:447794
PubChem ID:20481152
Update Time:2025-04-19

1,2-Benzenedicarbonyl dichloride, 4-methoxy- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenedicarbonyl dichloride, 4-methoxy-
    • 4-methoxybenzene-1,2-dicarbonyl chloride
    • DTXSID30607804
    • SCHEMBL11197823
    • 62366-69-2
    • 4-Methoxybenzene-1,2-dicarbonyl dichloride
    • Inchi: 1S/C9H6Cl2O3/c1-14-5-2-3-6(8(10)12)7(4-5)9(11)13/h2-4H,1H3
    • InChI Key: IVQWDLILPHMPHM-UHFFFAOYSA-N
    • SMILES: ClC(C1C=C(C=CC=1C(=O)Cl)OC)=O

Computed Properties

  • Exact Mass: 231.96948
  • Monoisotopic Mass: 231.9693994g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 242
  • 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: 3.1
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37
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