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
-2.1146 0.5110 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8908 -0.2530 0.0657 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8836 -1.3008 -0.6128 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3268 0.2498 0.5370 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5360 -0.3524 0.2909 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2617 -0.0611 -0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0299 0.9290 1.4458 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2064 1.3459 -0.3328 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0338 -0.1219 0.3864 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8907 -1.0836 0.9831 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2092 -0.5393 -0.9403 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9348 0.6765 -1.4819 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