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
2.3132 -0.2235 -0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8851 -0.5120 -0.3239 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5943 -1.4969 -1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1876 0.2509 0.1823 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5302 -0.0988 -0.1369 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5156 0.6143 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4884 0.7955 0.3185 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8558 -0.3017 -1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6900 -0.9705 0.6617 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0169 1.0697 0.7899 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7654 -0.9516 -0.7709 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3155 1.4574 0.9623 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5293 0.3672 0.1084 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