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
-2.2705 0.0430 -0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0147 -0.3248 0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0143 -1.0113 1.5666 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2225 0.1195 -0.0403 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4559 -0.1984 0.5838 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5751 0.2293 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0879 -0.6797 0.0199 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0588 0.0632 -1.2908 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5658 1.0381 0.1759 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1964 0.6976 -0.9335 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4227 -0.7856 1.4846 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5189 -0.0096 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6207 0.8187 -0.8556 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