2-Hydroxy-5-nitropyridine - CAS 5418-51-9

Name: 2-Hydroxy-5-nitropyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	5-nitro-1H-pyridin-2-one
Description:	5-Nitropyridin-2(1H)-one can be used for molecular crystal optical materials.
Molecular Weight:	140.10
Molecular Formula:	C5H4N2O3
Canonical SMILES:	C1=CC(=O)NC=C1[N+](=O)[O-]
InChI:	InChI=1S/C5H4N2O3/c8-5-2-1-4(3-6-5)7(9)10/h1-3H,(H,6,8)
InChI Key:	XKWSQIMYNVLGBO-UHFFFAOYSA-N
Boiling Point:	334 °C at 760 mmHg
Melting Point:	188-191 °C
Purity:	98 %
Density:	1.44 g/cm³
Appearance:	Light yellow to beige crystalline powder
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00006276
LogP:	1.21860

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112745259-A	One-pot synthesis method for synthesizing 2-hydroxy-5-nitropyridine	20210204
CN-112851485-A	Preparation method of ticagrelor key intermediate	20210115
WO-2021209552-A1	Pyrazolo[1,5-d][1,2,4]triazine-5(4h)-acetamides as inhibitors of the nlrp3 inflammasome pathway	20200415
CN-113264945-A	Spiro derivative, preparation method and medical application thereof	20200217
WO-2021158707-A1	Methods and compounds for the treatment of genetic disease	20200203

PMID	Publication Date	Title	Journal
16248071	20050101	Synthesis of N3,5'-cyclo-4-(beta-D-ribofuranosyl)-vic-triazolo[4,5-b]pyridin-5-one and its 3'-deoxysugar analogue as potential anti-hepatitis C virus agents	Nucleosides, nucleotides & nucleic acids
15537363	20041118	Synthesis of N3,5'-cyclo-4-(beta-D-ribofuranosyl)-vic-triazolo[4,5-b]pyridin-5-one, a novel compound with anti-hepatitis C virus activity	Journal of medicinal chemistry
12948195	20030807	Substitution reactions of 5-nitropyridine-2-sulfonic acid. A new pathway to 2,5-disubstituted pyridines	Organic & biomolecular chemistry

Complexity:	236
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.02219199
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	140.02219199
Rotatable Bond Count:	0
Topological Polar Surface Area:	74.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2