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

Name: 2-Butyl-4-chloroquinoline
Brand: BOC Sciences
Rating: 5 (1 reviews)

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

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Related Functional Groups

Quinoline/Isoquinoline

[1936054-65-7]C11H9Cl2N
2,4-Dichloro-3,6-dimethylquinoline
[938001-63-9]C11H12ClN3
9-Chloro-1-methyl-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-b]quinoline
[1031928-21-8]C17H14ClN
2-Chloro-7,8-dimethyl-3-phenylquinoline
[1245816-24-3]C21H33NSn
8-(Tributylstannyl)isoquinoline
[179943-57-8]C12H10BrNO3
Ethyl 7-Bromo-4-hydroxy-3-quinolinecarboxylate
[491-30-5]C9H7NO
Isocarbostyril

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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

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