6-Bromo-3-hydroxy-4-methyl-2-nitropyridine - CAS 1303587-93-0

Catalog:	BB007090
Product Name:	6-Bromo-3-hydroxy-4-methyl-2-nitropyridine
CAS:	1303587-93-0
Synonyms:	6-bromo-4-methyl-2-nitro-3-pyridinol; 6-bromo-4-methyl-2-nitropyridin-3-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	6-bromo-4-methyl-2-nitropyridin-3-ol
Description:	6-Bromo-3-hydroxy-4-methyl-2-nitropyridine (CAS# 1303587-93-0 ) is a useful research chemical.
Molecular Weight:	233.02
Molecular Formula:	C6H5BrN2O3
Canonical SMILES:	CC1=CC(=NC(=C1O)[N+](=O)[O-])Br
InChI:	InChI=1S/C6H5BrN2O3/c1-3-2-4(7)8-6(5(3)10)9(11)12/h2,10H,1H3
InChI Key:	IVIQYHVAIQWYNO-UHFFFAOYSA-N
LogP:	2.28950

Publication Number	Title	Priority Date
EA-034977-B1	DERIVATIVES OF BENZOXASININ AND ITS ANALOGUES AS TNF ACTIVITY MODULATORS	20150608
EP-3303318-A1	Benzoxazinone derivatives and analogues thereof as modulators of tnf activity	20150608
US-10287299-B2	Substituted benzo[b][1,4]oxazines and pyrido[3,2-b][1,4]oxazines as modulators of tumor necrosis factor activity	20150608
US-2018134728-A1	Benzoxazinone Derivatives and Analogues Thereof as Modulators of TNF Activity	20150608
WO-2016198400-A1	Benzoxazinone derivatives and analogues thereof as modulators of tnf activity	20150608

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Related Functional Groups

Pyridines

[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[14993-80-7]
2-(6-Methylpyridin-2-yl)acetonitrile
[149463-07-0]
2-(Chloromethyl)-3-fluoropyridine Hydrochloride
[1202402-53-6]
2-[6-(Bromomethyl)-2-pyridyl]-2-propanol
[267242-99-9]
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
[2122800-15-9]
3-(Phenyl-4-D)-N,N-dimethyl-3-(2-pyridyl)-1-propanamine

Complexity:	184
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	231.94835
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	231.94835
Rotatable Bond Count:	0
Topological Polar Surface Area:	78.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6