AG00AB7Y

16727-28-9 | 8-HYDROXY-6-NITROQUINOLINE

AG00AB7Y

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CAS Number	16727-28-9
Catalog Number	AG00AB7Y(AGN-PC-0JTNXD)
Chemical Name	8-HYDROXY-6-NITROQUINOLINE
IUPAC Name	6-nitroquinolin-8-ol
InChI	InChI=1S/C9H6N2O3/c12-8-5-7(11(13)14)4-6-2-1-3-10-9(6)8/h1-5,12H
InChI Key	BVBQGQLGXJDKLZ-UHFFFAOYSA-N
MDL Number	MFCD00466084
Molecular Formula	C9H6N2O3
Molecular Weight	190.1555
SMILES	OC1=CC(=CC2=C1N=CC=C2)[N+]([O-])=O
Synonyms	6-nitroquinolin-8-ol, 16727-28-9, 8-Hydroxy-6-nitroquinoline, 6-Nitro-8-quinolinol, 6-Nitro-quinolin-8-ol, MLS000682078, SMR000313481, ZERO/000196, AC1LCRAI, 6-Nitro-8-quinolinol #, 8-Quinolinol, 6-nitro-, Quinolin-8-ol, 6-nitro-, Oprea1_057596, Oprea1_075023, cid_605332, SCHEMBL2167844, CHEMBL1330558, BDBM49874, CTK0H2074, ZINC78149, DTXSID90345533, BVBQGQLGXJDKLZ-UHFFFAOYSA-N, HMS2640N17, KUC104588N, KS-000029ZW, ANW-71909, BBL007740, KSC-8-124, MFCD00466084, SBB001523, STK051450, AKOS001748751, MCULE-2532563996, PS-3645, AJ-10435, AK-62578, ST092809, ZB002777, AB0091738, DB-081051, TC-160654, EU-0052111, FT-0621270, Y7767, L-3199, SR-01000523979, SR-01000523979-1, W-205965, I14-33750, F0907-4179, 6-aminoquinolin-8-ol, C9H6N2O3, CID605332,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.038g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.158g/mol
Monoisotopic Mass	190.038g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	78.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number