3,6-Dibromo-2-pyrazinecarboxylic Acid - CAS 957230-68-1

Catalog:	BB041830
Product Name:	3,6-Dibromo-2-pyrazinecarboxylic Acid
CAS:	957230-68-1
Synonyms:	3,6-dibromo-2-pyrazinecarboxylic acid; 3,6-dibromopyrazine-2-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	3,6-dibromopyrazine-2-carboxylic acid
Description:	3,6-Dibromo-2-pyrazinecarboxylic Acid (CAS# 957230-68-1) is a useful research chemical.
Molecular Weight:	281.89
Molecular Formula:	C5H2Br2N2O2
Canonical SMILES:	C1=C(N=C(C(=N1)Br)C(=O)O)Br
InChI:	InChI=1S/C5H2Br2N2O2/c6-2-1-8-4(7)3(9-2)5(10)11/h1H,(H,10,11)
InChI Key:	MJOLIBQBOIULPY-UHFFFAOYSA-N
Boiling Point:	368.724 °C at 760 mmHg
Density:	2.334 g/cm³
MDL:	MFCD13193674
LogP:	1.69980

Publication Number	Title	Priority Date
US-2011118269-A1	Fused pyrazine compounds as their salts, useful for the treatment of degenerative and inflammatory diseases	20091105
WO-2011054922-A1	Salts of fused pyrazine compounds, useful for the treatment of degenerative and inflammatory diseases.	20091105
US-2011059118-A1	Inhibitors of jak	20090910
US-8618103-B2	Inhibitors of JAK	20090910
WO-2011029804-A1	Inhibitors of jak	20090910

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid

Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	281.84625
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	279.8483
Rotatable Bond Count:	1
Topological Polar Surface Area:	63.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7