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
2.1882 -0.0300 -0.1558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8138 -0.1790 0.3878 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5053 -0.1704 1.5892 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1958 -0.3405 -0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5198 -0.4901 -0.1825 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2760 0.5791 -0.0561 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4406 -0.8570 -0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9467 0.0690 0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1743 0.8989 -0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8795 -1.4913 -0.0133 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8904 1.5654 -0.2312 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3074 0.4460 0.2314 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