Home Carboxys 6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid

6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid

CAS No.:
1222-43-1
Catalog Number:
AG01BALG
Molecular Formula:
C12H12N2O5
Molecular Weight:
264.2341
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Product Description
Catalog Number:
AG01BALG
Chemical Name:
6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxaline-2-carboxylic acid
CAS Number:
1222-43-1
Molecular Formula:
C12H12N2O5
Molecular Weight:
264.2341
MDL Number:
MFCD18449054
IUPAC Name:
6,7-dimethoxy-4-methyl-3-oxoquinoxaline-2-carboxylic acid
InChI:
InChI=1S/C12H12N2O5/c1-14-7-5-9(19-3)8(18-2)4-6(7)13-10(11(14)15)12(16)17/h4-5H,1-3H3,(H,16,17)
InChI Key:
AAFOBWIAEKIODG-UHFFFAOYSA-N
SMILES:
COc1cc2nc(C(=O)O)c(=O)n(c2cc1OC)C
Properties
Complexity:
422  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.075g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.237g/mol
Monoisotopic Mass:
264.075g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties