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
1.1912 0.3065 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2690 0.0286 0.0519 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7178 -1.1590 -0.2973 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1500 1.0508 0.5355 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8567 1.9014 0.9301 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4660 0.0841 -1.1216 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4041 1.3717 0.1832 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7904 -0.2997 0.6507 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7786 -1.3560 -0.2128 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0796 -1.9283 -0.6577 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