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Home Carboxys 5-(4-Fluoro-phenyl)-isoxazole-3-carboxylic acid

5-(4-Fluoro-phenyl)-isoxazole-3-carboxylic acid

CAS No.:
33282-24-5
Catalog Number:
AG007GGT
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
96%
In Stock USA
United States
$75
- +
250mg
96%
In Stock USA
United States
$125
- +
1g
96%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG007GGT
Chemical Name:
5-(4-Fluoro-phenyl)-isoxazole-3-carboxylic acid
CAS Number:
33282-24-5
Molecular Formula:
C10H6FNO3
Molecular Weight:
207.1579
MDL Number:
MFCD04969899
IUPAC Name:
5-(4-fluorophenyl)-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C10H6FNO3/c11-7-3-1-6(2-4-7)9-5-8(10(13)14)12-15-9/h1-5H,(H,13,14)
InChI Key:
OFWUBERMKPVMCT-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1onc(c1)C(=O)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.16g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
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