Cas no 897008-37-6 (ethyl 3,6-dimethylpyridazine-4-carboxylate)

ethyl 3,6-dimethylpyridazine-4-carboxylate structure
897008-37-6 structure
Product Name:ethyl 3,6-dimethylpyridazine-4-carboxylate
CAS No:897008-37-6
MF:C8H10N2O2
MW:166.177201747894
CID:1089944
PubChem ID:71721448
Update Time:2025-04-20

ethyl 3,6-dimethylpyridazine-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 3,6-dimethylpyridazine-4-carboxylate
    • 3,6-Dimethyl-pyridazine-4-carboxyli c acid methyl est
    • ethyl 3,6-dimethylpyridazine-4-carboxylate
    • 897008-37-6
    • DTXSID40857010
    • Methyl3,6-dimethylpyridazine-4-carboxylate
    • Inchi: 1S/C8H10N2O2/c1-5-4-7(8(11)12-3)6(2)10-9-5/h4H,1-3H3
    • InChI Key: PODUIWRYNRLLHB-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=C(C)N=NC=1C)=O

Computed Properties

  • Exact Mass: 166.074227566g/mol
  • Monoisotopic Mass: 166.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 172
  • 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: 0.5
  • Topological Polar Surface Area: 52.1?2

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