1,2,3,4,5,6-Hexabromocyclohexane

Inquiry

Molecular Formula:

C6H6Br6

Molecular Weight:

557.54

CAS Number:

1837-91-8

Catalog Number:

1837-91-8

Product Information

Molecular Formula:

C6H6Br6

Molecular Weight:

557.54

Description

1,2,3,4,5,6-Hexabromocyclohexane is a potent inhibitor of JAK2 tyrosine kinase autophosphorylation. It inhibits JAK2 activation, and reduces growth hormone-mediated JAK2 autophosphorylation.

Synonyms

Benzene Hexabromide; JAK2 Inhibitor II

IUPAC Name

1,2,3,4,5,6-hexabromocyclohexane

Canonical SMILES

C1(C(C(C(C(C1Br)Br)Br)Br)Br)Br

InChI

InChI=1S/C6H6Br6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H

InChI Key

QFQZKISCBJKVHI-UHFFFAOYSA-N

Melting Point

218.0 to 223.0 °C

Purity

>98%

Appearance

White to Almost white powder to crystal

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

557.55083 g/mol

Monoisotopic Mass

551.55698 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

104

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
WO-2021231274-A1	Methods and systems for analyzing targetable pathologic processes in covid-19 via gene expression analysis	2020-05-11
WO-2021167096-A1	Styrene-based resin composition, flame retardant styrene-based resin composition, molded body, and patch antenna	2020-02-21
WO-2021125340-A1	Medium for culturing and expanding nephron progenitor cells, method for culturing and expanding nephron progenitor cells, and method for producing renal organoids	2019-12-19
EP-3854455-A1	Ttp phosphorylation as a biomarker in targeted therapy	2019-12-11
US-2021177852-A1	Ttp phosphorylation as a biomarker in targeted therapy	2019-12-11
JP-2021075613-A	Flame Retardant Masterbatch and Flame Retardant Styrene Resin Composition Using It	2019-11-07
WO-2020212374-A1	Silyl functional compound for improving flame retardant properties	2019-04-16
WO-2020212377-A1	Silyl functional compound for improving flame retardant properties	2019-04-16
WO-2020196096-A1	Foamable polystyrene resin particles, polystyrene pre-foamed particles, and foamed molded product	2019-03-25
JP-2020152816-A	Flame-retardant styrene resin composition, molded product, and extruded sheet	2019-03-20

Literatures

PMID	Publication Date	Title	Journal
21490369	2011-07-01	Growth hormone-stimulated insulin-like growth factor-1 expression in rainbow trout (Oncorhynchus mykiss) hepatocytes is mediated by ERK, PI3K-AKT, and JAK-STAT	American journal of physiology. Regulatory, integrative and comparative physiology
22649371	2011-01-01	ERK, Akt, and STAT5 are Differentially Activated by the Two Growth Hormone Receptor Subtypes of a Teleost Fish (Oncorhynchus Mykiss)	Frontiers in endocrinology
20562009	2010-08-30	Prolactin-induced Jak2 phosphorylation of RUSH: a key element in Jak/RUSH signaling	Molecular and cellular endocrinology
19234487	2009-04-09	Jak2 inhibition deactivates Lyn kinase through the SET-PP2A-SHP1 pathway, causing apoptosis in drug-resistant cells from chronic myelogenous leukemia patients	Oncogene
17178722	2007-02-09	Erlotinib effectively inhibits JAK2V617F activity and polycythemia vera cell growth	The Journal of biological chemistry
15801842	2005-04-07	Identification of 1,2,3,4,5,6-hexabromocyclohexane as a small molecule inhibitor of jak2 tyrosine kinase autophosphorylation [correction of autophophorylation]	Journal of medicinal chemistry

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