Home Aldehydes 2-Quinoxalinecarboxaldehyde, 1,4-dioxide

2-Quinoxalinecarboxaldehyde, 1,4-dioxide

CAS No.:
17626-51-6
Catalog Number:
AG0024JP
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
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Product Description
Catalog Number:
AG0024JP
Chemical Name:
2-Quinoxalinecarboxaldehyde, 1,4-dioxide
CAS Number:
17626-51-6
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD25960088
IUPAC Name:
1-oxido-4-oxoquinoxalin-4-ium-2-carbaldehyde
InChI:
InChI=1S/C9H6N2O3/c12-6-7-5-10(13)8-3-1-2-4-9(8)11(7)14/h1-6H
InChI Key:
JZJFIUXMPBVEFS-UHFFFAOYSA-N
SMILES:
O=Cc1c[n+]([O-])c2c([n+]1[O-])cccc2
UNII:
JR731A439B
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties