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
2.2068 -0.0357 -0.5983 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8080 -0.1843 -0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5196 -1.1959 0.6145 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1785 0.7453 -0.3212 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4600 0.5818 0.1739 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3698 -0.0691 -0.5555 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3702 -0.9215 -1.2547 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3244 0.8497 -1.2191 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9439 -0.0902 0.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6894 0.9845 1.1355 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3733 -0.2009 -0.1753 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1020 -0.4636 -1.5253 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