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Home Carboxys Methyl 3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-carboxylate

Methyl 3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-carboxylate

CAS No.:
202195-67-3
Catalog Number:
AG002840
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$40
- +
5g
98%
In Stock USA
United States
$122
- +
10g
98%
In Stock USA
United States
$200
- +
25g
98%
In Stock USA
United States
$363
- +
Product Description
Catalog Number:
AG002840
Chemical Name:
Methyl 3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-carboxylate
CAS Number:
202195-67-3
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD03036646
IUPAC Name:
methyl 3-oxo-4H-1,4-benzoxazine-6-carboxylate
InChI:
InChI=1S/C10H9NO4/c1-14-10(13)6-2-3-8-7(4-6)11-9(12)5-15-8/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
WPGYGHFVLMZWHI-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)NC(=O)CO2
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.185g/mol
Monoisotopic Mass:
207.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.6A^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