3-Hydroxy-2-methyl-1,4-dihydroquinolin-4-one - CAS 34497-54-6

Catalog:	BB022158
Product Name:	3-Hydroxy-2-methyl-1,4-dihydroquinolin-4-one
CAS:	34497-54-6
Synonyms:	3-hydroxy-2-methyl-1H-quinolin-4-one; 3-hydroxy-2-methyl-1H-quinolin-4-one

Technical Data

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Computed Properties

IUPAC Name:	3-hydroxy-2-methyl-1H-quinolin-4-one
Description:	3-Hydroxy-2-methyl-1,4-dihydroquinolin-4-one (CAS# 34497-54-6) is a useful research chemical.
Molecular Weight:	175.18
Molecular Formula:	C10H9NO2
Canonical SMILES:	CC1=C(C(=O)C2=CC=CC=C2N1)O
InChI:	InChI=1S/C10H9NO2/c1-6-9(12)10(13)7-4-2-3-5-8(7)11-6/h2-5,12H,1H3,(H,11,13)
InChI Key:	FSCXZVPPDJYLDD-UHFFFAOYSA-N
LogP:	1.54210

Publication Number	Title	Priority Date
US-10370654-B2	Processes and host cells for genome, pathway, and biomolecular engineering	20130802
US-2016186168-A1	Processes and host cells for genome, pathway, and biomolecular engineering	20130802
US-2018320170-A1	Processes and host cells for genome, pathway, and biomolecular engineering	20130802
US-2019309289-A1	Processes and host cells for genome, pathway, and biomolecular engineering	20130802
US-9944925-B2	Processes and host cells for genome, pathway, and biomolecular engineering	20130802

PMID	Publication Date	Title	Journal
20064436	20091224	Dioxygenase-mediated quenching of quinolone-dependent quorum sensing in Pseudomonas aeruginosa	Chemistry & biology
18638417	20080720	Structural analysis of urate oxidase in complex with its natural substrate inhibited by cyanide: mechanistic implications	BMC structural biology
18549245	20080708	Thermodynamic analysis of denaturant-induced unfolding of HodC69S protein supports a three-state mechanism	Biochemistry
17565175	20070501	Crystallization and diffraction data of 1H-3-hydroxy-4-oxoquinoline 2,4-dioxygenase: a cofactor-free oxygenase of the alpha/beta-hydrolase family	Acta crystallographica. Section F, Structural biology and crystallization communications
17565176	20070501	Crystallization and preliminary X-ray analysis of 1H-3-hydroxy-4-oxoquinaldine 2,4-dioxygenase from Arthrobacter nitroguajacolicus Rü61a: a cofactor-devoid dioxygenase of the alpha/beta-hydrolase-fold superfamily	Acta crystallographica. Section F, Structural biology and crystallization communications

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Complexity:	270
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.06332853
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	175.06332853
Rotatable Bond Count:	0
Topological Polar Surface Area:	49.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8