Monomers
N-Vinylacetamide
Identifiers
IUPAC name
N-ethenylacetamide
InchI
InChI=1S/C4H7NO/c1-3-5-4(2)6/h3H,1H2,2H3,(H,5,6)
InchI Key
RQAKESSLMFZVMC-UHFFFAOYSA-N
SMILES
CC(=O)NC=C
Canonical SMILES
CC(=O)NC=C
Isomeric SMILES
CC(=O)NC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H7NO
Heavy Atom Count
6
Molecular Weight
85.106
Exact Molecular Weight
85.0528
Valence Electrons
34
Radical Electrons
0
tPSA
29.1
MolLogP
0.266
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
13 12 0 0 0 0 0 0 0 0999 V2000
2.2287 0.1363 0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7497 0.0232 0.3909 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3324 -0.0637 1.5629 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1708 0.0166 -0.6897 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5653 -0.0806 -0.6025 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2618 -0.1820 0.4887 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3963 -0.1884 -0.9247 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5317 1.2068 0.1826 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7854 -0.4427 0.8674 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3007 0.0967 -1.6562 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0935 -0.0666 -1.5736 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3631 -0.2493 0.3712 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8703 -0.2063 1.4835 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 1 0
5 6 2 3
1 7 1 0
1 8 1 0
1 9 1 0
4 10 1 0
5 11 1 0
6 12 1 0
6 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers