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
2.2087 0.1447 0.1319 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7515 -0.0741 0.4329 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2886 0.0541 1.6013 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1022 -0.4271 -0.6103 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4392 -0.6298 -0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3020 0.3508 -0.4129 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6171 -0.7082 -0.4388 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7089 0.3167 1.1003 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3152 1.0728 -0.4926 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7620 -1.6135 -0.0791 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3408 0.1582 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9437 1.3553 -0.6889 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