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
-2.1710 0.2115 0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7633 -0.2447 0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4642 -0.8184 1.3166 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1261 -0.0258 -0.7976 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4237 -0.4771 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2771 0.3683 -0.0614 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3871 0.8359 1.0138 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8064 -0.6916 0.0867 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3318 0.8683 -0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7611 -1.4598 -0.8909 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3172 0.0742 0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0186 1.3593 0.2412 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