8-Bromo-5-nitroquinoline - CAS 139366-35-1

Catalog:	BB008930
Product Name:	8-Bromo-5-nitroquinoline
CAS:	139366-35-1
Synonyms:	8-bromo-5-nitroquinoline; 8-bromo-5-nitroquinoline

Technical Data

Patents

Computed Properties

IUPAC Name:	8-bromo-5-nitroquinoline
Description:	8-Bromo-5-nitroquinoline (CAS# 139366-35-1) is a useful research chemical.
Molecular Weight:	253.05
Molecular Formula:	C9H5BrN2O2
Canonical SMILES:	C1=CC2=C(C=CC(=C2N=C1)Br)[N+](=O)[O-]
InChI:	InChI=1S/C9H5BrN2O2/c10-7-3-4-8(12(13)14)6-2-1-5-11-9(6)7/h1-5H
InChI Key:	LEMUPVPKQOTZAE-UHFFFAOYSA-N
LogP:	3.42870

Publication Number	Title	Priority Date
CN-112390751-A	Toll-like receptor-7 small molecule inhibitor and preparation method thereof	20201105
AU-2002361785-B2	Fused heterocyclic succinimidecompounds and analogs thereof, modulators of nuclear hormone receptor function	20011219
CA-2471342-A1	Fused heterocyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function	20011219
CN-1589271-A	Fused heterocyclic succinimide compounds and analogs thereof as modulators of nuclear hormone receptor function	20011219
EP-1458723-A1	Fused heterocyclic succinimidecompounds and analogs thereof, modulators of nuclear hormone receptor function	20011219

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Complexity:	231
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	251.95344
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	251.95344
Rotatable Bond Count:	0
Topological Polar Surface Area:	58.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1