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
2.2338 0.0526 0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8242 -0.1446 -0.2737 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5042 -0.1578 -1.4897 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2187 -0.3265 0.6464 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5196 -0.5077 0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3298 0.5156 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2812 -0.2588 1.2617 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8666 -0.6263 -0.4136 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5295 1.0987 0.0469 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8127 -1.5319 0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3346 0.3561 -0.3529 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0242 1.5307 0.1826 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