Cas no 672-81-1 (2-(methoxymethylidene)propanedinitrile)

2-(Methoxymethylidene)propanedinitrile is a versatile chemical intermediate characterized by its reactive dinitrile and methoxymethylidene functional groups. This compound is particularly valuable in organic synthesis, serving as a precursor for heterocyclic compounds and other fine chemicals. Its electron-withdrawing nitrile groups enhance reactivity in cyclization and condensation reactions, making it useful in the preparation of pharmaceuticals, agrochemicals, and specialty materials. The methoxymethylidene moiety further contributes to its utility in nucleophilic addition and polymerization processes. With high purity and stability under controlled conditions, this compound is a reliable choice for advanced synthetic applications requiring precise molecular frameworks.
2-(methoxymethylidene)propanedinitrile structure
672-81-1 structure
Product Name:2-(methoxymethylidene)propanedinitrile
CAS No:672-81-1
MF:C5H4N2O
MW:108.09806060791
MDL:MFCD07437817
CID:509473
PubChem ID:69599
Update Time:2025-06-08

2-(methoxymethylidene)propanedinitrile Chemical and Physical Properties

Names and Identifiers

    • Propanedinitrile,2-(methoxymethylene)-
    • (Methoxymethylene)malononitrile
    • (methoxymethylidene)propanedinitrile
    • 2-(methoxymethylidene)propanedinitrile
    • InChI=1/C5H4N2O/c1-8-4-5(2-6)3-7/h4H,1H
    • SY161188
    • Propanedinitrile, 2-(methoxymethylene)-
    • DTXSID50217484
    • F8887-5632
    • 2-(methoxymethylene)malononitrile
    • D86348
    • 672-81-1
    • NS00042802
    • PPIRRJFTJMFMSM-UHFFFAOYSA-N
    • methoxymethylenemalononitrile
    • MFCD07437817
    • SCHEMBL1717333
    • AKOS026676790
    • (methoxymethylidene)malononitrile
    • EINECS 211-597-4
    • EN300-177658
    • DS-012301
    • MDL: MFCD07437817
    • Inchi: 1S/C5H4N2O/c1-8-4-5(2-6)3-7/h4H,1H3
    • InChI Key: PPIRRJFTJMFMSM-UHFFFAOYSA-N
    • SMILES: O(C)/C=C(\C#N)/C#N

Computed Properties

  • Exact Mass: 108.03242
  • Monoisotopic Mass: 108.032362755g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 169
  • 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: 0.1
  • Topological Polar Surface Area: 56.8?2

Experimental Properties

  • PSA: 56.81

2-(methoxymethylidene)propanedinitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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