Home Other Building Blocks 2-fluoro-5-[methyl(propan-2-yl)sulfamoyl]benzoic acid

2-fluoro-5-[methyl(propan-2-yl)sulfamoyl]benzoic acid

CAS No.:
926191-54-0
Catalog Number:
AG019LK9
Molecular Formula:
C11H14FNO4S
Molecular Weight:
275.2966
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Product Description
Catalog Number:
AG019LK9
Chemical Name:
2-fluoro-5-[methyl(propan-2-yl)sulfamoyl]benzoic acid
CAS Number:
926191-54-0
Molecular Formula:
C11H14FNO4S
Molecular Weight:
275.2966
MDL Number:
MFCD00092890
IUPAC Name:
2-fluoro-5-[methyl(propan-2-yl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C11H14FNO4S/c1-7(2)13(3)18(16,17)8-4-5-10(12)9(6-8)11(14)15/h4-7H,1-3H3,(H,14,15)
InChI Key:
QMNPHSRUPNIRLX-UHFFFAOYSA-N
SMILES:
CC(N(S(=O)(=O)c1ccc(c(c1)C(=O)O)F)C)C
Properties
Complexity:
404  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.063g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.294g/mol
Monoisotopic Mass:
275.063g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties