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
-2.2503 0.2783 0.5294 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0673 -0.2718 -0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1766 -1.1202 -1.0972 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2391 0.1366 0.2118 N 0 0 0 0 0 0 0 0 0 0 0 0
1.3966 -0.3765 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6016 0.0064 -0.0848 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2415 1.3857 0.4515 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1527 -0.1375 0.0605 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1585 0.0291 1.6047 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3154 0.8355 0.9852 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2852 -1.0944 -1.2264 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7604 0.7347 0.7162 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4487 -0.4059 -0.5984 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