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
2.1360 0.5194 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8235 -0.1565 -0.0522 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7441 -1.2188 0.6134 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3287 0.3230 -0.6519 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4985 -0.3866 -0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2643 -0.0950 0.5319 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8060 0.1694 0.6175 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0138 1.6223 -0.0158 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5510 0.3332 -1.1602 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8184 -1.1742 -1.1619 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9768 0.6774 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1877 -0.6138 0.7107 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