CHEBI:52701 - 1-hydroxy-1,3-dioxobenziodoxole

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-hydroxy-1,3-dioxobenziodoxole
ChEBI ID CHEBI:52701
Definition A benziodoxole compound having hydroxy and oxo substituents at the 1-position and an oxo substituent at the 3-position. It is a mild and efficient hypervalent iodine synthetic reagent used to carry out several selective oxidation reactions.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Colin Batchelor
Supplier Information
Download Molfile XML SDF
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C7H5IO4
Net Charge 0
Average Mass 280.01670
Monoisotopic Mass 279.92325
InChI InChI=1S/C7H5IO4/c9-7-5-3-1-2-4-6(5)8(10,11)12-7/h1-4H,(H,10,11)
InChIKey CQMJEZQEVXQEJB-UHFFFAOYSA-N
SMILES OI1(=O)OC(=O)c2ccccc12
Roles Classification
Chemical Role(s): oxidising agent
A substance that removes electrons from another reactant in a redox reaction.
Biological Role(s): EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor
An EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor which interferes with the activity of the enzyme protein tyrosine phosphatases (PTPs), EC 3.1.3.48, involved in the removal of phosphate groups from phosphorylated tyrosine residues on proteins.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hydroxy-1,3-dioxobenziodoxole (CHEBI:52701) has role EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor (CHEBI:35608)
1-hydroxy-1,3-dioxobenziodoxole (CHEBI:52701) has role oxidising agent (CHEBI:63248)
1-hydroxy-1,3-dioxobenziodoxole (CHEBI:52701) is a benziodoxole (CHEBI:52705)
1-hydroxy-1,3-dioxobenziodoxole (CHEBI:52701) is tautomer of ortho-iodylbenzoic acid (CHEBI:52700)
Incoming ortho-iodylbenzoic acid (CHEBI:52700) is tautomer of 1-hydroxy-1,3-dioxobenziodoxole (CHEBI:52701)
IUPAC Name
1-hydroxy-1λ3,2-benziodoxol-3(1H)-one 1-oxide
Synonyms Sources
1-hydroxy-1,2-benziodoxol-3(1H)-one 1-oxide ChEBI
1-Hydroxy-1,2-benziodoxol-3-on-1-oxid ChEBI
1-hydroxy-1,2-benziodoxole-3(1H)-one 1-oxide ChEBI
1-hydroxy-1,3-dioxo-3H-benz[d][1,2]iodoxol ChEBI
1-hydroxy-1-oxo-1λ5,2-benziodoxol-3-one ChEBI
1-hydroxy-1λ5,2-benziodoxole-1,3(1H)-dione IUPAC
1-hydroxy-1λ5,2-benziodoxole-1,3-dione ChEBI
1-hydroxy-3H-benz[d][1,2]iodoxol-1,3-dione ChEBI
1-hydroxyl-2-benziodoxol-3(1H)-one 1-oxide ChEBI
IBX ChEBI
SIBX ChEBI
stabilized IBX ChEBI
Manual Xref Database
2-Iodoxybenzoic_acid Wikipedia
View more database links
Registry Numbers Types Sources
61717-82-6 CAS Registry Number ChEBI
976364 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
10091683 PubMed citation Europe PMC
11457049 PubMed citation Europe PMC
11796071 PubMed citation Europe PMC
11878977 PubMed citation Europe PMC
11878978 PubMed citation Europe PMC
12074652 PubMed citation Europe PMC
12182609 PubMed citation Europe PMC
12608839 PubMed citation Europe PMC
12816514 PubMed citation Europe PMC
12943417 PubMed citation Europe PMC
12973775 PubMed citation Europe PMC
1420464 PubMed citation Europe PMC
15099102 PubMed citation Europe PMC
15763595 PubMed citation Europe PMC
15987173 PubMed citation Europe PMC
16218584 PubMed citation Europe PMC
16292876 PubMed citation Europe PMC
16465333 PubMed citation Europe PMC
16566050 PubMed citation Europe PMC
16637095 PubMed citation Europe PMC
17221993 PubMed citation Europe PMC
18345680 PubMed citation Europe PMC
18512969 PubMed citation Europe PMC
18973384 PubMed citation Europe PMC
19082096 PubMed citation Europe PMC
19610592 PubMed citation Europe PMC
19685250 PubMed citation Europe PMC
19924094 PubMed citation Europe PMC
20715768 PubMed citation Europe PMC
20820531 PubMed citation Europe PMC
21247180 PubMed citation Europe PMC
21271626 PubMed citation Europe PMC
21364550 PubMed citation Europe PMC
21820458 PubMed citation Europe PMC
22023037 PubMed citation Europe PMC
22148366 PubMed citation Europe PMC
22290292 PubMed citation Europe PMC
22423599 PubMed citation Europe PMC
22780104 PubMed citation Europe PMC
24014894 PubMed citation Europe PMC
24309193 PubMed citation Europe PMC
24481496 PubMed citation Europe PMC
24512551 PubMed citation Europe PMC
25271695 PubMed citation Europe PMC
26020465 PubMed citation Europe PMC
26368318 PubMed citation Europe PMC
26891598 PubMed citation Europe PMC
26937585 PubMed citation Europe PMC
27409144 PubMed citation Europe PMC
28497968 PubMed citation Europe PMC
28497973 PubMed citation Europe PMC
29166031 PubMed citation Europe PMC
29236486 PubMed citation Europe PMC
30254705 PubMed citation Europe PMC
30354121 PubMed citation Europe PMC
30996775 PubMed citation Europe PMC
31244157 PubMed citation Europe PMC
31956767 PubMed citation Europe PMC
32192330 PubMed citation Europe PMC
33507605 PubMed citation Europe PMC
33801611 PubMed citation Europe PMC
34410728 PubMed citation Europe PMC
35295969 PubMed citation Europe PMC
36162101 PubMed citation Europe PMC
Last Modified
31 March 2023
General Comment
2023-03-27 Relevant articles: https://doi.org/10.1039/A605253C