6-Bromo-4-hydroxyquinoline-3-carboxylic acid - CAS 98948-95-9

Catalog:	BB042234
Product Name:	6-Bromo-4-hydroxyquinoline-3-carboxylic acid
CAS:	98948-95-9
Synonyms:	6-bromo-4-oxo-1H-quinoline-3-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	6-bromo-4-oxo-1H-quinoline-3-carboxylic acid
Description:	6-Bromo-4-hydroxyquinoline-3-carboxylic acid (CAS# 98948-95-9) is a useful research chemical.
Molecular Weight:	268.06
Molecular Formula:	C10H6BrNO3
Canonical SMILES:	C1=CC2=C(C=C1Br)C(=O)C(=CN2)C(=O)O
InChI:	InChI=1S/C10H6BrNO3/c11-5-1-2-8-6(3-5)9(13)7(4-12-8)10(14)15/h1-4H,(H,12,13)(H,14,15)
InChI Key:	GIUZUAUCCUFVKW-UHFFFAOYSA-N
Boiling Point:	412.1 °C at 760 mmHg
Density:	1.804 g/cm³
LogP:	2.40110

Publication Number	Title	Priority Date
CN-113185505-A	Quinolone oxazolidinone compound and preparation method and application thereof	20210407
WO-2020245430-A1	Benzo[h][1,6] naphthyridin-2(1h)-ones as bmx inhibitors, for use against cancer	20190607
WO-2020219729-A1	Papd5 inhibitors and methods of use thereof	20190424
CN-109942654-B	Macrolide and quinolone heterocomplex and preparation method thereof	20190227
CN-105859684-B	Fused ring compound and preparation method, application and intermediate compound thereof	20160415

PMID	Publication Date	Title	Journal
17064064	20061102	Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2	Journal of medicinal chemistry

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Related Functional Groups

Quinoline/Isoquinoline

[948291-36-9]
2,5-Dichloro-8-methylquinoline-3-carboxaldehyde
[1031928-21-8]
2-Chloro-7,8-dimethyl-3-phenylquinoline
[312713-96-5]
7-Chloro-6-methyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
[7651-83-4]
7-Isoquinolinol
[50741-46-3]
Ethyl 3-quinolinecarboxylate
[79660-46-1]
Ethyl 6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate

GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Complexity:	340
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	266.95311
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	266.95311
Rotatable Bond Count:	1
Topological Polar Surface Area:	66.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5