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
-2.2535 -0.4220 -0.2808 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9627 0.2932 -0.4274 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9700 1.5249 -0.7088 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2573 -0.3137 -0.2732 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4538 0.3736 -0.4147 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6275 -0.2085 -0.2667 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1952 -1.4916 -0.5023 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9795 0.0268 -0.9782 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6736 -0.3050 0.7507 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4073 1.4186 -0.6539 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7491 -1.2546 -0.0262 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5395 0.3583 -0.3844 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