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
2.2012 0.3713 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8507 -0.0827 0.1972 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6106 -0.3395 1.4107 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2067 -0.2468 -0.6802 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4502 -0.6694 -0.2344 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4067 0.1333 0.1635 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1708 1.4676 -0.5257 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5634 -0.1680 -1.1326 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8791 0.3176 0.6264 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6325 -1.7322 -0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2342 1.1925 0.1505 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3455 -0.2437 0.4973 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