2-Bromo-6-chloropyrazine - CAS 916791-07-6

Catalog:	BB040308
Product Name:	2-Bromo-6-chloropyrazine
CAS:	916791-07-6
Synonyms:	2-bromo-6-chloropyrazine

Technical Data

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Computed Properties

IUPAC Name:	2-bromo-6-chloropyrazine
Description:	2-Bromo-6-chloropyrazine (CAS# 916791-07-6) is a useful research chemical.
Molecular Weight:	193.43
Molecular Formula:	C4H2BrClN2
Canonical SMILES:	C1=C(N=C(C=N1)Br)Cl
InChI:	InChI=1S/C4H2BrClN2/c5-3-1-7-2-4(6)8-3/h1-2H
InChI Key:	UZAXEXBMDHIXNU-UHFFFAOYSA-N
Boiling Point:	210.5 °C at 760 mmHg
Purity:	97 %
Density:	1.859 g/cm³
LogP:	1.89250

Publication Number	Title	Priority Date
US-2019382402-A1	Indazole containing macrocycles and therapeutic uses thereof	20180615
WO-2019241540-A1	Indazole containing macrocycles and therapeutic uses thereof	20180615
US-10759799-B2	Indazole containing macrocycles and therapeutic uses thereof	20180615
CN-110143949-A	It can be used as the new type heterocycle derivative of SHP2 inhibitor	20180509
CN-107585980-A	It is a kind of to be used to fix diatom soil matrix curing agent of cadmium in river bottom mud and preparation method thereof	20171013

PMID	Publication Date	Title	Journal
20936789	20101111	Aminopyrazine inhibitors binding to an unusual inactive conformation of the mitotic kinase Nek2: SAR and structural characterization	Journal of medicinal chemistry

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Complexity:	80.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.90899
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	191.90899
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6