Home Halogens 3-bromo-2-chloro-5-sulfamoylbenzoic acid

3-bromo-2-chloro-5-sulfamoylbenzoic acid

CAS No.:
1461707-46-9
Catalog Number:
AG01A5ND
Molecular Formula:
C7H5BrClNO4S
Molecular Weight:
314.5409
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Product Description
Catalog Number:
AG01A5ND
Chemical Name:
3-bromo-2-chloro-5-sulfamoylbenzoic acid
CAS Number:
1461707-46-9
Molecular Formula:
C7H5BrClNO4S
Molecular Weight:
314.5409
MDL Number:
MFCD25970274
IUPAC Name:
3-bromo-2-chloro-5-sulfamoylbenzoic acid
InChI:
InChI=1S/C7H5BrClNO4S/c8-5-2-3(15(10,13)14)1-4(6(5)9)7(11)12/h1-2H,(H,11,12)(H2,10,13,14)
InChI Key:
JHTIBPIRWXWQIL-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(cc(c1Cl)Br)S(=O)(=O)N
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.881g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
314.534g/mol
Monoisotopic Mass:
312.881g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties