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
2.1730 0.4210 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7786 -0.0729 -0.3581 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3240 -0.3392 -1.4976 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0808 -0.2633 0.7122 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3665 -0.7252 0.4908 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3307 0.1395 0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 0.9421 -1.0819 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1761 1.1638 0.6425 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7831 -0.4561 0.1084 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5785 -1.8055 0.4883 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1021 1.1888 0.2903 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3189 -0.1929 0.1127 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