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
1.1861 -0.3199 0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2467 0.0626 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8085 0.1956 -1.0987 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0191 0.2864 1.2718 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6633 0.4738 2.2245 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4331 -1.1766 -0.5087 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7684 0.5942 -0.1397 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4710 -0.6281 1.1821 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2700 0.0381 -2.0253 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8511 0.4740 -1.1409 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