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
2.0483 -0.2503 -0.7905 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8483 0.3105 -0.1073 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9440 1.1140 0.8555 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3971 -0.0582 -0.5383 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5916 0.3910 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1168 -0.3093 1.0065 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2279 -1.3059 -0.4602 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8524 -0.3038 -1.8869 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9568 0.3162 -0.5771 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0930 1.2884 -0.3539 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6452 -1.1992 1.3882 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0341 0.0065 1.4529 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