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
2.1444 -0.7592 -0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7653 -0.3387 -0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3429 -0.4028 -1.5227 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0546 0.1237 0.6514 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3396 0.5058 0.3116 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3729 -0.2987 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8068 -0.5732 -0.9414 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5638 -0.1241 0.7719 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2433 -1.8429 0.1619 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4994 1.5306 0.0297 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3473 0.0574 0.0371 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2527 -1.3334 0.5877 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