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
-2.2104 -0.2322 0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7996 0.2396 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5084 0.9240 -1.1346 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2290 -0.0555 0.7463 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4940 0.4192 0.4475 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2836 -0.3292 -0.2741 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2876 -0.3632 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3523 -1.2346 -0.3707 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9047 0.5075 -0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8361 1.4047 0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9515 -1.2793 -0.6184 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2688 -0.0011 -0.5282 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