Home Other Building Blocks 2-(2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-2-oxoacetic acid

2-(2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-2-oxoacetic acid

CAS No.:
1094294-14-0
Catalog Number:
AG01B9AL
Molecular Formula:
C10H6N2O5
Molecular Weight:
234.1650
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Product Description
Catalog Number:
AG01B9AL
Chemical Name:
2-(2,3-dioxo-1,2,3,4-tetrahydroquinoxalin-6-yl)-2-oxoacetic acid
CAS Number:
1094294-14-0
Molecular Formula:
C10H6N2O5
Molecular Weight:
234.1650
MDL Number:
MFCD11179620
IUPAC Name:
2-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)-2-oxoacetic acid
InChI:
InChI=1S/C10H6N2O5/c13-7(10(16)17)4-1-2-5-6(3-4)12-9(15)8(14)11-5/h1-3H,(H,11,14)(H,12,15)(H,16,17)
InChI Key:
BQCTUIJLPNDSTC-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2
Properties
Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.028g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
234.167g/mol
Monoisotopic Mass:
234.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties