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
2.2150 -0.0114 0.2395 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7565 -0.2997 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2924 -0.9055 1.2278 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0888 0.0494 -0.7846 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4233 -0.2705 -0.6852 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2793 0.5547 -0.1322 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5664 0.1180 -0.8023 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3322 0.9715 0.7751 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7360 -0.8077 0.7841 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7567 -1.2108 -1.0689 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0144 1.5195 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3359 0.2924 -0.0578 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