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
2.2612 0.0409 -0.0824 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7853 0.2927 -0.2428 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3834 1.2852 -0.8875 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1760 -0.5760 0.3245 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5713 -0.4642 0.2549 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2849 0.4524 -0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7965 0.1301 -1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3683 -0.9807 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6037 0.7888 0.6615 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2172 -1.4001 0.8596 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1838 -1.2462 0.7651 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3573 0.4152 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8423 1.2617 -0.8671 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