Home Halogens 4-bromo-3-[methyl(phenyl)sulfamoyl]benzoic acid

4-bromo-3-[methyl(phenyl)sulfamoyl]benzoic acid

CAS No.:
941196-03-8
Catalog Number:
AG019W00
Molecular Formula:
C14H12BrNO4S
Molecular Weight:
370.2184
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019W00
Chemical Name:
4-bromo-3-[methyl(phenyl)sulfamoyl]benzoic acid
CAS Number:
941196-03-8
Molecular Formula:
C14H12BrNO4S
Molecular Weight:
370.2184
MDL Number:
MFCD09398341
IUPAC Name:
4-bromo-3-[methyl(phenyl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C14H12BrNO4S/c1-16(11-5-3-2-4-6-11)21(19,20)13-9-10(14(17)18)7-8-12(13)15/h2-9H,1H3,(H,17,18)
InChI Key:
MDJTWFKHYMOLDR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)S(=O)(=O)N(c1ccccc1)C)Br
Properties
Complexity:
470  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.967g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
370.217g/mol
Monoisotopic Mass:
368.967g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties