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
0.3024 -1.0899 -0.5102 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0932 0.1729 0.1336 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3278 1.3659 -0.2495 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0019 0.1085 1.2582 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7435 0.0532 2.1447 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5294 -1.4155 -1.1719 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4294 -1.8628 0.3009 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2665 -0.9838 -1.0345 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0123 1.3717 -1.1026 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0297 2.2799 0.2312 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