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
2.1817 0.2888 0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7694 -0.1280 0.3739 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3864 -0.4533 1.5253 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1377 -0.1770 -0.6649 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4282 -0.5838 -0.3831 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3518 0.2914 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4280 0.1869 -0.8611 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8799 -0.4182 0.7441 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3921 1.2866 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6484 -1.6335 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1028 1.3329 0.0228 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3686 0.0071 0.1867 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