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
2.1935 -0.2229 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7595 -0.5600 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3079 -1.5814 0.4903 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1401 0.3644 -0.6041 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4997 0.2010 -0.5749 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2170 0.6595 0.4166 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3609 0.6929 0.4448 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3721 0.0630 -1.2472 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0284 0.1588 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9954 -0.3096 -1.3727 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7245 1.1740 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2833 0.5476 0.4686 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