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
2.1853 -0.4058 0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7168 -0.2217 0.3177 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3260 0.1799 1.4418 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2353 -0.4827 -0.6459 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5843 -0.2878 -0.3247 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1152 0.8976 -0.5489 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2802 -1.3937 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7035 -0.4028 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5936 0.4140 -0.5672 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1684 -1.0785 0.0913 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5527 1.7156 -0.9674 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1495 1.0657 -0.3085 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