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
2.2246 0.1081 0.1247 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7506 -0.1695 0.1852 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3947 -1.3637 0.0994 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1546 0.8205 0.3259 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5124 0.6861 0.3925 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2238 -0.4038 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4445 1.1416 0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7515 -0.5681 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6066 -0.0964 -0.8896 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1012 1.6201 0.5098 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3317 -0.3657 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8489 -1.4091 0.2252 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