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
-2.2519 0.3301 -0.2352 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9614 -0.3930 -0.0348 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9128 -1.6275 0.1242 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2403 0.3013 -0.0197 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4356 -0.3729 0.1665 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5556 0.3141 0.1756 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0683 -0.3473 -0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4260 0.9629 0.6336 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1324 1.0245 -1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4816 -1.4567 0.3063 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5320 -0.1156 0.3126 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5077 1.3800 0.0379 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