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
2.2351 0.2017 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8288 -0.2720 -0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5099 -1.0534 -1.1858 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1900 0.1432 0.6006 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5046 -0.2857 0.4283 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3749 0.3490 -0.3092 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4849 0.9516 -0.8281 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9171 -0.6637 -0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3257 0.6010 0.9828 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7696 -1.2002 0.9554 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0964 1.2528 -0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3659 -0.0243 -0.4052 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