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
2.1282 0.1090 -0.7092 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8427 -0.0740 -0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7337 0.1031 1.2274 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2757 -0.4460 -0.7167 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4797 -0.6147 -0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3339 0.3831 0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4222 -0.7543 -1.3332 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9307 0.2307 0.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1334 1.0116 -1.3801 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7277 -1.5864 0.3519 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0984 1.3585 -0.2862 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2755 0.2794 0.6236 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