Monomers
Vinyl acetate
Identifiers
IUPAC name
ethenyl acetate
InchI
InChI=1S/C4H6O2/c1-3-6-4(2)5/h3H,1H2,2H3
InchI Key
XTXRWKRVRITETP-UHFFFAOYSA-N
SMILES
CC(=O)OC=C
Canonical SMILES
CC(=O)OC=C
Isomeric SMILES
CC(=O)OC=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.693
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
2.1571 -0.1756 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7215 -0.3218 0.2329 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3218 -0.6097 1.3828 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1760 -0.1405 -0.8016 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5224 -0.2936 -0.4971 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1824 0.7672 -0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3825 0.0517 -1.0776 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6926 -1.1196 0.2961 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5897 0.6745 0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0279 -1.2377 -0.5718 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7330 1.7382 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2234 0.6670 0.1338 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
5 10 1 0
6 11 1 0
6 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers