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
2.2423 -0.0361 -0.1289 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7367 -0.2065 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2452 -1.1873 -0.7577 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0759 0.6934 0.4561 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4249 0.6294 0.4856 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2470 -0.2348 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5741 -0.1205 -1.1823 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7108 -0.8061 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4748 1.0067 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9112 1.4687 1.0449 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9909 -1.1092 -0.5913 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3338 -0.0978 0.1221 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