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
-2.2399 0.0539 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8060 -0.2513 -0.2544 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4287 -0.6208 -1.3957 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1878 -0.1439 0.7094 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5016 -0.4291 0.4146 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3142 0.5035 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9325 -0.5987 -0.5174 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3970 1.1096 -0.2284 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3606 -0.0738 1.1321 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8635 -1.4272 0.5445 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3474 0.3440 -0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9502 1.5338 -0.1587 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