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
2.1642 0.3175 0.3198 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8226 -0.2407 0.0872 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7042 -1.3210 -0.5416 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3475 0.3607 0.5262 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6006 -0.1895 0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2571 0.1317 -0.7984 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5438 0.7747 -0.6231 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8538 -0.5248 0.5684 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2109 1.0412 1.1559 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0439 -0.8724 0.9842 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8198 0.8131 -1.4935 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2306 -0.2905 -0.9885 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