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1268865-77-5 | 6-Quinoxalinecarboxylic acid, 1,2,3,4-tetrahydro-2,3-dioxo-, ethyl ester
CAS No: 1268865-77-5 Catalog No: AG000TF4 MDL No:MFCD26143073
Product Description
Catalog Number:
AG000TF4
Chemical Name:
6-Quinoxalinecarboxylic acid, 1,2,3,4-tetrahydro-2,3-dioxo-, ethyl ester
CAS Number:
1268865-77-5
Molecular Formula:
C11H10N2O4
Molecular Weight:
234.2081
MDL Number:
MFCD26143073
IUPAC Name:
ethyl 2,3-dioxo-1,4-dihydroquinoxaline-6-carboxylate
InChI:
InChI=1S/C11H10N2O4/c1-2-17-11(16)6-3-4-7-8(5-6)13-10(15)9(14)12-7/h3-5H,2H2,1H3,(H,12,14)(H,13,15)
InChI Key:
ZYHOQGSGEKXSMW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.064g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.211g/mol
Monoisotopic Mass:
234.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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