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
2.2385 -0.1716 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8046 -0.0266 -0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4060 -0.4095 -1.6319 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1438 0.5294 0.3423 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4785 0.6740 -0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3345 -0.2959 0.2588 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6140 -1.1855 -0.2538 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8006 0.5982 -0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3149 0.1526 0.9731 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8316 1.5681 -0.4943 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0055 -1.1987 0.7449 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3845 -0.2346 0.0080 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