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
2.2448 -0.0452 -0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8074 -0.2997 0.3037 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4477 -0.7341 1.4332 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2108 -0.0711 -0.6178 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5512 -0.3138 -0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2893 0.6438 0.2371 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8472 -0.7022 0.6369 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3826 -0.2704 -1.0857 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4332 1.0267 0.1702 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9564 -1.2835 -0.4894 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3043 0.4339 0.4728 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8507 1.6156 0.4218 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