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
-2.2632 0.1370 -0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9259 -0.4156 0.1504 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8128 -1.5912 0.5705 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2372 0.3128 -0.0283 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4973 -0.2165 0.2411 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5443 0.5229 0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2969 0.6000 -1.1451 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5742 0.9120 0.6188 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0123 -0.6789 -0.1421 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6172 -1.2388 0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5283 0.1333 0.2529 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4612 1.5230 -0.3058 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