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
1.0949 -0.3118 0.5051 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2254 0.1098 -0.0387 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6645 -0.2930 -1.2008 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0440 0.9889 0.7409 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6875 1.7071 1.3597 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9080 -0.9461 1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6507 0.5750 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6581 -0.9024 -0.2507 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6245 0.0330 -1.5609 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0658 -0.9605 -1.8154 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