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
2.0955 -0.5280 -0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7488 -0.4518 0.1705 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5103 -0.6685 1.3851 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3442 -0.1215 -0.6279 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6206 -0.0383 -0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0406 1.0974 0.3624 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8006 -1.0692 0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0077 -0.9510 -1.4395 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5474 0.4945 -0.5682 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2622 -0.8978 -0.0832 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0283 1.1697 0.7689 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4145 1.9646 0.3483 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