Cas no 75625-07-9 (Carbonocyanidic acid, methyl ester, N-oxide)

Carbonocyanidic acid, methyl ester, N-oxide structure
75625-07-9 structure
Product Name:Carbonocyanidic acid, methyl ester, N-oxide
CAS No:75625-07-9
MF:C3H3NO3
MW:101.060820817947
CID:539253
PubChem ID:12640355
Update Time:2025-04-19

Carbonocyanidic acid, methyl ester, N-oxide Chemical and Physical Properties

Names and Identifiers

    • Carbonocyanidic acid, methyl ester, N-oxide
    • methyl 2-oxidoiminoacetate
    • DTXSID50505338
    • methoxy carbonyl formonitrile oxide
    • [(E)-(2-Methoxy-2-oxoeth-1-ylium-1-ylidene)amino]oxidanide
    • 75625-07-9
    • Inchi: 1S/C3H3NO3/c1-7-3(5)2-4-6/h1H3
    • InChI Key: TWDRJLQYWBVSAF-UHFFFAOYSA-N
    • SMILES: O(C(/[C+]=N/[O-])=O)C

Computed Properties

  • Exact Mass: 101.011292958g/mol
  • Monoisotopic Mass: 101.011292958g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 88.2
  • 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: -0.3
  • Topological Polar Surface Area: 61.7?2

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