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
   -1.1954    2.0222    1.2830 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6340    1.1476    0.7716 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0715    0.0471    0.1354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4380   -0.4263   -0.9851 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2500   -0.5207    0.6553 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2335   -0.9910    1.0694 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0515   -1.2385   -1.4870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3389   -0.0404   -1.4427 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