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
-0.5934 -1.9246 -1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1890 -1.0610 -0.2585 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2046 -1.5175 0.3376 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1380 0.3047 0.0016 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6304 1.1100 0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2897 2.3636 1.0877 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3838 -2.4203 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1069 -2.6901 -1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0858 -1.3662 -1.9674 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9760 0.6712 -0.4941 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4998 0.7436 1.3989 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8309 3.0256 1.7412 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5742 2.7610 0.5840 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