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
2.1457 -0.3714 0.2276 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8381 0.2852 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7377 1.3352 -0.6353 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2815 -0.2615 0.6127 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5482 0.2773 0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3057 -0.1069 -0.5112 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8727 0.3139 0.7253 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6098 -0.6512 -0.7601 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0949 -1.2735 0.8433 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8706 0.9906 1.2292 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3130 0.2881 -0.6487 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9799 -0.8258 -1.2503 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