Home Sulfos 2-(((4-fluorophenyl)sulfonyl)amino)-benzoicaci

2-(((4-fluorophenyl)sulfonyl)amino)-benzoicaci

CAS No.:
51012-30-7
Catalog Number:
AG00DI1S
Molecular Formula:
C13H10FNO4S
Molecular Weight:
295.2862
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Product Description
Catalog Number:
AG00DI1S
Chemical Name:
2-(((4-fluorophenyl)sulfonyl)amino)-benzoicaci
CAS Number:
51012-30-7
Molecular Formula:
C13H10FNO4S
Molecular Weight:
295.2862
MDL Number:
MFCD00114880
IUPAC Name:
2-[(4-fluorophenyl)sulfonylamino]benzoic acid
InChI:
InChI=1S/C13H10FNO4S/c14-9-5-7-10(8-6-9)20(18,19)15-12-4-2-1-3-11(12)13(16)17/h1-8,15H,(H,16,17)
InChI Key:
YPVRMONLTQLVQE-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)O
Properties
Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.031g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
295.284g/mol
Monoisotopic Mass:
295.031g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties