1,2,3,4,5,6-Hexabromocyclohexane
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
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.
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].
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
5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
0
Exact Mass
557.55083 g/mol
Monoisotopic Mass
551.55698 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
104
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
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 |
