2-Bromo-5-(chloromethyl)pyridine Hydrochloride - CAS 1126779-39-2

Catalog:	BB003020
Product Name:	2-Bromo-5-(chloromethyl)pyridine Hydrochloride
CAS:	1126779-39-2
Synonyms:	2-bromo-5-(chloromethyl)pyridine;hydrochloride; 2-bromo-5-(chloromethyl)pyridine;hydrochloride

Technical Data

Patents

Computed Properties

IUPAC Name:	2-bromo-5-(chloromethyl)pyridine;hydrochloride
Description:	2-Bromo-5-(chloromethyl)pyridine Hydrochloride (CAS# 1126779-39-2 ) is a useful research chemical.
Molecular Weight:	242.93
Molecular Formula:	C6H6BrCl2N
Canonical SMILES:	C1=CC(=NC=C1CCl)Br.Cl
InChI:	InChI=1S/C6H5BrClN.ClH/c7-6-2-1-5(3-8)4-9-6;/h1-2,4H,3H2;1H
InChI Key:	GLEYJNYBNZURDU-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	3.38490

Publication Number	Title	Priority Date
AU-2014285019-A1	Substituted benzofuranyl and benzoxazolyl compounds and uses thereof	20130703
AU-2014285019-B2	Substituted benzofuranyl and benzoxazolyl compounds and uses thereof	20130703
AU-2014285019-C1	Substituted benzofuranyl and benzoxazolyl compounds and uses thereof	20130703
AU-2019201642-A1	Substituted benzofuranyl and benzoxazolyl compounds and uses thereof	20130703
CA-2917315-A1	Substituted benzofuranyl and benzoxazolyl compounds and uses thereof	20130703

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Complexity:	89.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	240.90607
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	240.90607
Rotatable Bond Count:	1
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0