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Home Carboxys Pyrazine-2,3,5,6-tetracarboxylic acid

Pyrazine-2,3,5,6-tetracarboxylic acid

CAS No.:
43193-60-8
Catalog Number:
AG0074CI
Molecular Formula:
C8H4N2O8
Molecular Weight:
256.1260
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Purity
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Price(USD)
Quantity
  
1g
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United States
$523
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Product Description
Catalog Number:
AG0074CI
Chemical Name:
Pyrazine-2,3,5,6-tetracarboxylic acid
CAS Number:
43193-60-8
Molecular Formula:
C8H4N2O8
Molecular Weight:
256.1260
MDL Number:
MFCD18449240
IUPAC Name:
pyrazine-2,3,5,6-tetracarboxylic acid
InChI:
InChI=1S/C8H4N2O8/c11-5(12)1-2(6(13)14)10-4(8(17)18)3(9-1)7(15)16/h(H,11,12)(H,13,14)(H,15,16)(H,17,18)
InChI Key:
RTHVZRHBNXZKKB-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(C(=O)O)c(nc1C(=O)O)C(=O)O
EC Number:
256-137-3
Properties
Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.997g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
256.126g/mol
Monoisotopic Mass:
255.997g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
175A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Literature
Title Journal
catena-Poly[[(6-carb-oxy-pyrazine-2-carboxyl-ato)lithium]-μ-aqua]. Acta crystallographica. Section E, Structure reports online 20111201
catena-Poly[[(aqualithium)-μ-3-carboxypyrazine-2-carboxylato-κO,N:O,N] monohydrate]. Acta crystallographica. Section E, Structure reports online 20110801
catena-Poly[[(3,5-dicarb-oxy-pyrazine-2,6-dicarboxyl-ato-κO,N,O)lithium(I)]-μ-aqua-[triaqua-lithium(I)]-μ-aqua]. Acta crystallographica. Section E, Structure reports online 20101201
Poly[[bis-(μ(2)-6-methyl-pyrazin-2-carboxyl-ato-κN,O:N)copper(II)] dihydrate]. Acta crystallographica. Section E, Structure reports online 20091101
X-ray powder structure of a new two-dimensional nickel(II) coordination polymer with pyrazine-2,3,5,6-tetracarboxylic acid. Acta crystallographica. Section C, Crystal structure communications 20011001
Properties