2-Hydroxy-3-iodopyridine - CAS 111079-46-0

Name: 2-Hydroxy-3-iodopyridine
Brand: BOC Sciences
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Catalog:	BB002710
Product Name:	2-Hydroxy-3-iodopyridine
CAS:	111079-46-0
Synonyms:	3-iodo-1H-pyridin-2-one; 3-iodo-1H-pyridin-2-one

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	3-iodo-1H-pyridin-2-one
Description:	2-Hydroxy-3-iodopyridine (CAS# 111079-46-0) is a useful reagent for the preparation of 2-Pyridones, 2-quinolinones, 1-isoquinolinones and other N-heterocycles which are critical building blocks in medicinal chemistry.
Molecular Weight:	221.00
Molecular Formula:	C5H4INO
Canonical SMILES:	C1=CNC(=O)C(=C1)I
InChI:	InChI=1S/C5H4INO/c6-4-2-1-3-7-5(4)8/h1-3H,(H,7,8)
InChI Key:	YEMFHJFNJPXYOE-UHFFFAOYSA-N
Appearance:	Solid
LogP:	1.39180

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Related Functional Groups

Pyridines

[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide
[942206-23-7]C5H2Cl2IN
2,5-Dichloro-3-iodopyridine
[63585-69-3]C6H7ClN2O2
2-Methyl-3-nitropyridine Hydrochloride
[2122800-15-9]C16H19N2D
3-(Phenyl-4-D)-N,N-dimethyl-3-(2-pyridyl)-1-propanamine
[76006-14-9]C6H4ClN3
3-Chloro-1H-pyrazolo[3,4-c]pyridine
[884495-23-2]C6H5FIN
6-Fluoro-3-iodo-2-methylpyridine

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-111925320-A	Method for efficiently synthesizing polysubstituted 2-pyridone compound	20200812
WO-2021028362-A1	Shp2 inhibitors	20190809
WO-2021013799-A1	Substituted n-phenyl uracils, salts thereof and their use as herbicidal agents	20190722
WO-2021013800-A1	Substituted n-phenyl-n-aminouarcils and salts thereof and use thereof as herbicidal agents	20190722
CN-106588765-A	Method for hydroxylation of nitrogen oxide C2-position	20160906

PMID	Publication Date	Title	Journal
22909023	20120907	Total synthesis of lodopyridone	Organic letters
14629168	20031128	Palladium-catalyzed carbonylative annulation of internal alkynes: synthesis of 3,4-disubstituted coumarins	The Journal of organic chemistry

Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	220.93376
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	220.93376
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9