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
   -2.1643    0.1050    0.3989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8431   -0.2172   -0.1969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6740   -0.5332   -1.3962 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2755   -0.1663    0.6220 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5197   -0.4634    0.0866 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2767    0.4740   -0.4421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9929   -0.0337   -0.3042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3175   -0.5883    1.2624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1686    1.1377    0.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8893   -1.4733    0.0947 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2379    0.2397   -0.8549 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9614    1.5192   -0.4824 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