2-Butyl-4-chloroquinoline - CAS 144624-27-1

Catalog:	BB009804
Product Name:	2-Butyl-4-chloroquinoline
CAS:	144624-27-1
Synonyms:	2-butyl-4-chloroquinoline; 2-butyl-4-chloroquinoline

Technical Data

Patents

Computed Properties

IUPAC Name:	2-butyl-4-chloroquinoline
Description:	2-Butyl-4-chloroquinoline (CAS# 144624-27-1) is a useful research chemical.
Molecular Weight:	219.71
Molecular Formula:	C13H14ClN
Canonical SMILES:	CCCCC1=NC2=CC=CC=C2C(=C1)Cl
InChI:	InChI=1S/C13H14ClN/c1-2-3-6-10-9-12(14)11-7-4-5-8-13(11)15-10/h4-5,7-9H,2-3,6H2,1H3
InChI Key:	XSCKPTWTCYQMPD-UHFFFAOYSA-N
LogP:	4.23080

Publication Number	Title	Priority Date
FR-2680509-A1	BENZYL RADICAL SUBSTITUTED NITROGENIC BICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION, INTERMEDIATES OBTAINED, MEDICAMENT APPLICATION THEREOF AND COMPOSITIONS COMPRISING SAME.	19910820
FR-2680510-A1	NOVEL BICYCLIC NITROGENIC DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, THE NEW INTERMEDIATES OBTAINED, THEIR APPLICATION AS MEDICAMENTS AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME.	19910820
CA-2060771-A1	Nitrogenated bicyclic derivatives substitutes by a benzyl radical, process for their preparation, novel intermediates thus obtaines, their applications as drugs, and pharmaceutical compositions containing them	19910207
CN-1063869-A	New nitrogenous bicyclic derivatives, its preparation method, the new intermediate that obtains thus, its pharmaceutical use and the pharmaceutical composition that contains this class material	19910207
EP-0498722-A1	Bicyclic nitrogen compounds, their preparation, intermediates obtained, their use as pharmaceuticals and pharmaceutical compositions containing them	19910207

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Complexity:	195
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	219.0814771
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	219.0814771
Rotatable Bond Count:	3
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.8