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
2.2483 0.3598 0.0147 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9650 -0.2894 0.3347 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9880 -1.3820 0.9619 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2608 0.2234 -0.0089 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4772 -0.3726 0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5785 0.2256 -0.1042 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0733 -0.3461 0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2627 0.7610 -1.0326 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4237 1.1682 0.7504 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5713 -1.3076 0.8155 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5487 -0.1998 0.1003 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5245 1.1595 -0.6373 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