Home Sulfos 2-(4-fluoro-3-methylbenzenesulfonamido)benzoic acid

2-(4-fluoro-3-methylbenzenesulfonamido)benzoic acid

CAS No.:
379254-41-8
Catalog Number:
AG019GL2
Molecular Formula:
C14H12FNO4S
Molecular Weight:
309.3128
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019GL2
Chemical Name:
2-(4-fluoro-3-methylbenzenesulfonamido)benzoic acid
CAS Number:
379254-41-8
Molecular Formula:
C14H12FNO4S
Molecular Weight:
309.3128
MDL Number:
MFCD03147247
IUPAC Name:
2-[(4-fluoro-3-methylphenyl)sulfonylamino]benzoic acid
InChI:
InChI=1S/C14H12FNO4S/c1-9-8-10(6-7-12(9)15)21(19,20)16-13-5-3-2-4-11(13)14(17)18/h2-8,16H,1H3,(H,17,18)
InChI Key:
AJKYFGLLAORHRC-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1NS(=O)(=O)c1ccc(c(c1)C)F
Properties
Complexity:
476  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.047g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
309.311g/mol
Monoisotopic Mass:
309.047g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties