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
2.2414 -0.0994 0.1123 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7507 -0.2990 0.0106 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2686 -1.4443 -0.1267 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0715 0.7937 0.0707 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4303 0.8164 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2640 -0.1777 -0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7176 -1.0114 -0.2932 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5008 0.0107 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4666 0.7988 -0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8675 1.8318 0.0716 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9620 -1.1967 -0.2261 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3505 -0.0228 -0.1895 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