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Home Carboxys 2,3-Dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid

2,3-Dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid

CAS No.:
14121-55-2
Catalog Number:
AG001G2A
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$169
- +
5g
98%
In Stock USA
United States
$513
- +
Product Description
Catalog Number:
AG001G2A
Chemical Name:
2,3-Dioxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylic acid
CAS Number:
14121-55-2
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
MDL Number:
MFCD00907425
IUPAC Name:
2,3-dioxo-1,4-dihydroquinoxaline-6-carboxylic acid
InChI:
InChI=1S/C9H6N2O4/c12-7-8(13)11-6-3-4(9(14)15)1-2-5(6)10-7/h1-3H,(H,10,12)(H,11,13)(H,14,15)
InChI Key:
YGJDUUUPLPMKSN-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2
EC Number:
237-975-9
NSC Number:
211121
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
206.157g/mol
Monoisotopic Mass:
206.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties