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Home Carboxys Methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylate

Methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylate

CAS No.:
671820-52-3
Catalog Number:
AG006K9T
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$269
- +
5g
95%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG006K9T
Chemical Name:
Methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxylate
CAS Number:
671820-52-3
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD03830200
IUPAC Name:
methyl 3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylate
InChI:
InChI=1S/C10H10N2O3/c1-15-10(14)6-2-3-7-8(4-6)12-9(13)5-11-7/h2-4,11H,5H2,1H3,(H,12,13)
InChI Key:
YZJFTMHNIACXHE-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)NC(=O)CN2
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
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