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
-1.2036 0.1693 -0.2407 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2291 0.0540 0.1207 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8900 -0.9969 -0.3249 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8957 1.0363 0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4578 1.8289 1.5885 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2358 0.3217 -1.3477 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5994 1.1292 0.1939 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8164 -0.6659 0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9528 -1.1140 -0.0762 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4298 -1.7626 -0.9337 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