Cas no 21094-42-8 (3-(dimethylamino)-2-methylprop-2-enenitrile)

3-(Dimethylamino)-2-methylprop-2-enenitrile is a versatile nitrile derivative with applications in organic synthesis and pharmaceutical intermediates. Its structure features a reactive cyano group adjacent to an unsaturated bond, enabling participation in Michael additions, cyclizations, and other nucleophilic reactions. The dimethylamino substituent enhances solubility in polar solvents and can act as a directing group in catalytic transformations. This compound is particularly useful in the preparation of heterocyclic frameworks and functionalized acrylonitrile derivatives. Its stability under standard conditions and well-defined reactivity profile make it a valuable building block for fine chemical synthesis. Care should be taken during handling due to potential lachrymatory effects.
3-(dimethylamino)-2-methylprop-2-enenitrile structure
21094-42-8 structure
Product Name:3-(dimethylamino)-2-methylprop-2-enenitrile
CAS No:21094-42-8
MF:C6H10N2
MW:110.157001018524
CID:3908247
PubChem ID:73190240
Update Time:2025-05-22

3-(dimethylamino)-2-methylprop-2-enenitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Propenenitrile, 3-(dimethylamino)-2-methyl-
    • 3-(dimethylamino)-2-methylprop-2-enenitrile
    • AKOS026730009
    • 2-cyano-3-(dimethylamino)prop-2-ene
    • 21094-42-8
    • Inchi: 1S/C6H10N2/c1-6(4-7)5-8(2)3/h5H,1-3H3
    • InChI Key: HNUFCYBYFMHKEA-UHFFFAOYSA-N
    • SMILES: C(#N)C(C)=CN(C)C

Computed Properties

  • Exact Mass: 110.084398327Da
  • Monoisotopic Mass: 110.084398327Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 136
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 0.7
  • Topological Polar Surface Area: 27?2

3-(dimethylamino)-2-methylprop-2-enenitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B401798-10mg
3-(dimethylamino)-2-methylprop-2-enenitrile
21094-42-8
10mg
$ 50.00 2022-06-07
TRC
B401798-50mg
3-(dimethylamino)-2-methylprop-2-enenitrile
21094-42-8
50mg
$ 160.00 2022-06-07
TRC
B401798-100mg
3-(dimethylamino)-2-methylprop-2-enenitrile
21094-42-8
100mg
$ 250.00 2022-06-07
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