Monomers

Vinylidene cyanide

Identifiers

IUPAC name
2-methylidenepropanedinitrile
InchI
InChI=1S/C4H2N2/c1-4(2-5)3-6/h1H2
InchI Key
FCYVWWWTHPPJII-UHFFFAOYSA-N
SMILES
N#CC(=C)C#N
Canonical SMILES
C=C(C#N)C#N
Isomeric SMILES
C=C(C#N)C#N
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H2N2
Heavy Atom Count
6
Molecular Weight
78.074
Exact Molecular Weight
78.0218
Valence Electrons
28
Radical Electrons
0
tPSA
47.58
MolLogP
0.5898
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

  8  7  0  0  0  0  0  0  0  0999 V2000
    2.1651   -0.7001    1.3485 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1995   -0.3995    0.7830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0100   -0.0489    0.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0254    0.6780   -1.0181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2362   -0.5475    0.6433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2425   -0.9358    1.1005 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9679    1.0181   -1.3908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8692    0.9357   -1.5403 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  3  0
  4  7  1  0
  4  8  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers