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
-2.2563 -0.3214 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9591 0.3556 0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9826 1.5693 0.3615 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2685 -0.2550 -0.0629 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4746 0.3650 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5758 -0.3378 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8394 0.1741 -1.0359 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1265 -1.3919 -0.4734 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8360 -0.2581 0.7307 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5216 1.3949 0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5858 -1.3825 -0.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5736 0.0879 0.2244 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