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
2.1797 0.2507 0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7717 -0.1615 0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3467 -0.5452 1.4465 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1183 -0.1562 -0.7296 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4185 -0.5691 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3203 0.3260 -0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8324 -0.6450 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3460 0.9758 -0.5861 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4614 0.7349 1.1852 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6714 -1.6051 -0.6325 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3463 0.0300 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0630 1.3648 -0.0231 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