Home Sulfos 3-(4-fluorobenzenesulfonamido)naphthalene-2-carboxylic acid

3-(4-fluorobenzenesulfonamido)naphthalene-2-carboxylic acid

CAS No.:
926200-59-1
Catalog Number:
AG019ZQB
Molecular Formula:
C17H12FNO4S
Molecular Weight:
345.3449
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Product Description
Catalog Number:
AG019ZQB
Chemical Name:
3-(4-fluorobenzenesulfonamido)naphthalene-2-carboxylic acid
CAS Number:
926200-59-1
Molecular Formula:
C17H12FNO4S
Molecular Weight:
345.3449
MDL Number:
MFCD09043303
IUPAC Name:
3-[(4-fluorophenyl)sulfonylamino]naphthalene-2-carboxylic acid
InChI:
InChI=1S/C17H12FNO4S/c18-13-5-7-14(8-6-13)24(22,23)19-16-10-12-4-2-1-3-11(12)9-15(16)17(20)21/h1-10,19H,(H,20,21)
InChI Key:
VOAHLYLBMHCXON-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)S(=O)(=O)Nc1cc2ccccc2cc1C(=O)O
Properties
Complexity:
553  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.047g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
345.344g/mol
Monoisotopic Mass:
345.047g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties