Home Halogens 5-bromo-4-(methylsulfamoyl)thiophene-2-carboxylic acid

5-bromo-4-(methylsulfamoyl)thiophene-2-carboxylic acid

CAS No.:
1094550-30-7
Catalog Number:
AG01DUYX
Molecular Formula:
C6H6BrNO4S2
Molecular Weight:
300.1501
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Product Description
Catalog Number:
AG01DUYX
Chemical Name:
5-bromo-4-(methylsulfamoyl)thiophene-2-carboxylic acid
CAS Number:
1094550-30-7
Molecular Formula:
C6H6BrNO4S2
Molecular Weight:
300.1501
MDL Number:
MFCD11649777
IUPAC Name:
5-bromo-4-(methylsulfamoyl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C6H6BrNO4S2/c1-8-14(11,12)4-2-3(6(9)10)13-5(4)7/h2,8H,1H3,(H,9,10)
InChI Key:
OQNHSGXIZPQGLR-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)c1cc(sc1Br)C(=O)O
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.892g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
300.141g/mol
Monoisotopic Mass:
298.892g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties