Monomers
Methacrylonitrile
Identifiers
IUPAC name
2-methylprop-2-enenitrile
InchI
InChI=1S/C4H5N/c1-4(2)3-5/h1H2,2H3
InchI Key
GYCMBHHDWRMZGG-UHFFFAOYSA-N
SMILES
CC(=C)C#N
Canonical SMILES
CC(=C)C#N
Isomeric SMILES
CC(=C)C#N
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H5N
Heavy Atom Count
5
Molecular Weight
67.091
Exact Molecular Weight
67.0422
Valence Electrons
26
Radical Electrons
0
tPSA
23.79
MolLogP
1.0861
H Bond Acceptors
1
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
10 9 0 0 0 0 0 0 0 0999 V2000
1.0104 -0.4376 0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2058 0.1328 -0.0536 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8752 -0.4250 -1.0475 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6851 1.3865 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0526 2.3855 0.9624 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8890 -1.4848 0.8817 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3930 0.2002 1.3468 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8173 -0.4811 -0.2507 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5323 -1.3406 -1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7586 0.0642 -1.4185 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 3 0
1 6 1 0
1 7 1 0
1 8 1 0
3 9 1 0
3 10 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers