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
2.2242 0.1051 0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7987 -0.2708 0.1741 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4620 -0.9522 1.1715 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1758 0.0827 -0.7416 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4912 -0.3141 -0.5487 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3410 0.4500 0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4622 0.6220 -0.8902 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8265 -0.8340 0.1392 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4595 0.8005 0.8836 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8681 -1.2499 -0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3601 0.1712 0.2978 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9969 1.3896 0.5383 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