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
-2.2218 -0.1197 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8656 0.2316 0.2237 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6254 1.3271 0.8127 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1941 -0.6495 0.0613 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4767 -0.4122 0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3746 0.1797 -0.2567 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2550 0.1480 -1.3599 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0161 0.3645 0.3128 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2834 -1.2311 -0.2484 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7598 -0.7186 1.4795 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0796 0.4923 -1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3824 0.3880 0.0298 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