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
2.2210 -0.0310 0.1637 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7733 -0.0439 0.4658 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4133 0.4730 1.5644 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1904 -0.5699 -0.3512 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5260 -0.5320 0.0254 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3270 0.4733 -0.2816 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4523 -0.2138 -0.8971 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7099 -0.8749 0.7267 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7316 0.8880 0.5248 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9385 -1.3682 0.6017 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9652 1.3199 -0.8483 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3544 0.4796 0.0205 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