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
-2.1987 0.1644 0.2109 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8047 -0.1738 -0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5711 -0.3670 -1.3855 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1935 -0.2730 0.7705 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5167 -0.5905 0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3444 0.3948 0.1601 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9483 -0.4494 -0.3114 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4150 1.2298 -0.0773 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3429 0.1149 1.3109 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8047 -1.6213 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3834 0.1571 -0.0997 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0379 1.4141 0.1773 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