Home Sulfos 2-(4-fluorobenzenesulfonamidooxy)acetic acid

2-(4-fluorobenzenesulfonamidooxy)acetic acid

CAS No.:
790725-72-3
Catalog Number:
AG019NM2
Molecular Formula:
C8H8FNO5S
Molecular Weight:
249.2162
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Product Description
Catalog Number:
AG019NM2
Chemical Name:
2-(4-fluorobenzenesulfonamidooxy)acetic acid
CAS Number:
790725-72-3
Molecular Formula:
C8H8FNO5S
Molecular Weight:
249.2162
MDL Number:
MFCD06359955
IUPAC Name:
2-[(4-fluorophenyl)sulfonylamino]oxyacetic acid
InChI:
InChI=1S/C8H8FNO5S/c9-6-1-3-7(4-2-6)16(13,14)10-15-5-8(11)12/h1-4,10H,5H2,(H,11,12)
InChI Key:
JYCJJJKCRVCGKY-UHFFFAOYSA-N
SMILES:
OC(=O)CONS(=O)(=O)c1ccc(cc1)F
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.011g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.212g/mol
Monoisotopic Mass:
249.011g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
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