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
2.1767 0.2620 -0.3095 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8138 -0.2563 -0.0527 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6427 -1.2311 0.7537 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3131 0.2607 -0.6453 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5577 -0.2622 -0.3687 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2719 0.2085 0.6136 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9177 -0.3717 0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3635 0.3541 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2770 1.2897 0.1457 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9226 -1.0632 -0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8931 1.0070 1.2125 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2331 -0.1975 0.8248 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