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
-2.2341 0.2686 -0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7414 0.1917 0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2518 0.6865 1.1866 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0974 -0.4003 -0.7480 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4324 -0.5116 -0.6268 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2326 -0.1047 0.3265 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4755 1.1764 -0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5127 -0.5937 -0.7187 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7850 0.2024 0.8702 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9398 -1.0369 -1.4788 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3218 -0.2932 0.2438 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9765 0.4150 1.2299 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