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23433-66-1

23433-66-1 | 2-Quinoxalinecarboxamide, 3-methyl-, 1,4-dioxide

CAS No: 23433-66-1 Catalog No: AG002N7S MDL No:

Product Description

Catalog Number:
AG002N7S
Chemical Name:
2-Quinoxalinecarboxamide, 3-methyl-, 1,4-dioxide
CAS Number:
23433-66-1
Molecular Formula:
C10H9N3O3
Molecular Weight:
219.1968
IUPAC Name:
3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxamide
InChI:
InChI=1S/C10H9N3O3/c1-6-9(10(11)14)13(16)8-5-3-2-4-7(8)12(6)15/h2-5H,1H3,(H2,11,14)
InChI Key:
MZXRNZRWWVUJMH-UHFFFAOYSA-N
SMILES:
NC(=O)c1[n+]([O-])c2ccccc2[n+](c1C)[O-]

Properties

Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.2g/mol
Monoisotopic Mass:
219.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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