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159853-92-6

159853-92-6 | 2,3-Pyrazinedicarboxylic acid, 5-chloro-

CAS No: 159853-92-6 Catalog No: AG001RG7 MDL No:

Product Description

Catalog Number:
AG001RG7
Chemical Name:
2,3-Pyrazinedicarboxylic acid, 5-chloro-
CAS Number:
159853-92-6
Molecular Formula:
C6H3ClN2O4
Molecular Weight:
202.5520
IUPAC Name:
5-chloropyrazine-2,3-dicarboxylic acid
InChI:
InChI=1S/C6H3ClN2O4/c7-2-1-8-3(5(10)11)4(9-2)6(12)13/h1H,(H,10,11)(H,12,13)
InChI Key:
HLUIDKPBRYGSBH-UHFFFAOYSA-N
SMILES:
Clc1cnc(c(n1)C(=O)O)C(=O)O

Properties

Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.978g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
202.55g/mol
Monoisotopic Mass:
201.978g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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