2-Hydroxyquinoline-3-carboxylic Acid - CAS 2003-79-4

Catalog:	BB015473
Product Name:	2-Hydroxyquinoline-3-carboxylic Acid
CAS:	2003-79-4
Synonyms:	2-oxo-1H-quinoline-3-carboxylic acid; 2-oxo-1H-quinoline-3-carboxylic acid

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Computed Properties

IUPAC Name:	2-oxo-1H-quinoline-3-carboxylic acid
Description:	2-Hydroxyquinoline-3-carboxylic Acid (CAS# 2003-79-4) is a useful research chemical.
Molecular Weight:	189.17
Molecular Formula:	C10H7NO3
Canonical SMILES:	C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)O
InChI:	InChI=1S/C10H7NO3/c12-9-7(10(13)14)5-6-3-1-2-4-8(6)11-9/h1-5H,(H,11,12)(H,13,14)
InChI Key:	XOQQVKDBGLYPGH-UHFFFAOYSA-N
Boiling Point:	440.9 °C at 760 mmHg
Density:	1.429 g/cm³
LogP:	1.63860

Publication Number	Title	Priority Date
CN-110482958-A	Strong concrete and preparation method thereof and its application	20190916
CN-109535176-A	Quinolone glyoxaline compound and its preparation method and application	20181229
CN-109535176-B	Quinolone imidazole compound and preparation method and application thereof	20181229
CN-109096276-A	The preparation method of moxifloxacin hydrochloride and its intermediate	20180801
EP-3784656-A1	Process for the hydrolysis of quinolone carboxylic esters	20180425

PMID	Publication Date	Title	Journal
21886910	20110701	Taste masked microspheres of ofloxacin: formulation and evaluation of orodispersible tablets	Scientia pharmaceutica
21185178	20110115	6-Benzylamino 4-oxo-1,4-dihydro-1,8-naphthyridines and 4-oxo-1,4-dihydroquinolines as HIV integrase inhibitors	Bioorganic & medicinal chemistry letters
22131628	20110101	RP-HPLC Method for Simultaneous Estimation of Nitazoxanide and Ofloxacin in Tablets	Indian journal of pharmaceutical sciences
20701377	20100819	The mechanism of metal cation binding in two nalidixate calixarene conjugates. A langmuir film and molecular modeling study	The journal of physical chemistry. B
20805881	20100818	Structural insights into the quinolone resistance mechanism of Mycobacterium tuberculosis DNA gyrase	PloS one

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	309
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.042593085
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	189.042593085
Rotatable Bond Count:	1
Topological Polar Surface Area:	66.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6