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
2.1952 0.0745 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8025 0.0548 -0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5406 0.7208 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2010 -0.6700 0.4434 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4642 -0.6451 -0.0942 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3124 0.2650 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4736 -0.9504 0.6678 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1830 0.7005 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8839 0.4815 -0.4026 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7404 -1.3692 -0.8269 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0332 0.9970 1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3276 0.3404 -0.0874 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