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
-2.2020 0.0641 -0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7284 -0.0439 -0.6447 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2456 0.2684 -1.7525 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0946 -0.4925 0.3586 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4640 -0.6080 0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2399 0.4127 0.4437 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4580 1.1417 -0.2961 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4728 -0.4673 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6941 -0.3831 -1.2707 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8288 -1.5411 -0.2023 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3023 0.3044 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8712 1.3446 0.8138 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