Home Other Building Blocks 3-[(4-fluorophenyl)sulfamoyl]benzoic acid

3-[(4-fluorophenyl)sulfamoyl]benzoic acid

CAS No.:
300667-27-0
Catalog Number:
AG019GLR
Molecular Formula:
C13H10FNO4S
Molecular Weight:
295.2862
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Product Description
Catalog Number:
AG019GLR
Chemical Name:
3-[(4-fluorophenyl)sulfamoyl]benzoic acid
CAS Number:
300667-27-0
Molecular Formula:
C13H10FNO4S
Molecular Weight:
295.2862
MDL Number:
MFCD00622722
IUPAC Name:
3-[(4-fluorophenyl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C13H10FNO4S/c14-10-4-6-11(7-5-10)15-20(18,19)12-3-1-2-9(8-12)13(16)17/h1-8,15H,(H,16,17)
InChI Key:
OJVDUXURNHYJCV-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)NS(=O)(=O)c1cccc(c1)C(=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:
1.9  
Properties