Home Other Building Blocks 5-(cyclopropylsulfamoyl)-2-methylbenzoic acid

5-(cyclopropylsulfamoyl)-2-methylbenzoic acid

CAS No.:
926199-08-8
Catalog Number:
AG019OYR
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
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Product Description
Catalog Number:
AG019OYR
Chemical Name:
5-(cyclopropylsulfamoyl)-2-methylbenzoic acid
CAS Number:
926199-08-8
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
MDL Number:
MFCD09042131
IUPAC Name:
5-(cyclopropylsulfamoyl)-2-methylbenzoic acid
InChI:
InChI=1S/C11H13NO4S/c1-7-2-5-9(6-10(7)11(13)14)17(15,16)12-8-3-4-8/h2,5-6,8,12H,3-4H2,1H3,(H,13,14)
InChI Key:
JUPSKNUFMZEKFU-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(ccc1C)S(=O)(=O)NC1CC1
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.288g/mol
Monoisotopic Mass:
255.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties