6-Bromo-4-chloro-3-nitroquinoline - CAS 723281-72-9

Catalog:	BB034598
Product Name:	6-Bromo-4-chloro-3-nitroquinoline
CAS:	723281-72-9
Synonyms:	6-bromo-4-chloro-3-nitroquinoline; 6-bromo-4-chloro-3-nitroquinoline

Technical Data

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Computed Properties

IUPAC Name:	6-bromo-4-chloro-3-nitroquinoline
Description:	6-Bromo-4-chloro-3-nitroquinoline (CAS# 723281-72-9) is a useful research chemical.
Molecular Weight:	287.50
Molecular Formula:	C9H4BrClN2O2
Canonical SMILES:	C1=CC2=NC=C(C(=C2C=C1Br)Cl)[N+](=O)[O-]
InChI:	InChI=1S/C9H4BrClN2O2/c10-5-1-2-7-6(3-5)9(11)8(4-12-7)13(14)15/h1-4H
InChI Key:	KHKPVEMMXJCWGP-UHFFFAOYSA-N
Boiling Point:	387.626 °C at 760 mmHg
Density:	1.834 g/cm³
MDL:	MFCD09909913
LogP:	4.08210

Publication Number	Title	Priority Date
CN-112110941-A	Compound serving as Hippo signal pathway inhibitor	20190621
WO-2020063855-A1	Quinolino-pyrrolidin-2-one derivative and application thereof	20180930
CN-110950890-A	Substituted imidazo [4,5-c ] quinoline macrocycles as multi-target kinase inhibitors	20180927
WO-2020009946-A1	Therapeutic compounds and methods of use thereof	20180702
US-2021269438-A1	Therapeutic compounds and methods of use thereof	20180702

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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+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	261
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	285.91447
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	285.91447
Rotatable Bond Count:	0
Topological Polar Surface Area:	58.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3