Home Carboxys 3-[(4-methylphenyl)sulfamoyl]thiophene-2-carboxylic acid

3-[(4-methylphenyl)sulfamoyl]thiophene-2-carboxylic acid

CAS No.:
944894-01-3
Catalog Number:
AG01A8OC
Molecular Formula:
C12H11NO4S2
Molecular Weight:
297.3500
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Product Description
Catalog Number:
AG01A8OC
Chemical Name:
3-[(4-methylphenyl)sulfamoyl]thiophene-2-carboxylic acid
CAS Number:
944894-01-3
Molecular Formula:
C12H11NO4S2
Molecular Weight:
297.3500
MDL Number:
MFCD09455231
IUPAC Name:
3-[(4-methylphenyl)sulfamoyl]thiophene-2-carboxylic acid
InChI:
InChI=1S/C12H11NO4S2/c1-8-2-4-9(5-3-8)13-19(16,17)10-6-7-18-11(10)12(14)15/h2-7,13H,1H3,(H,14,15)
InChI Key:
GHNLVOMDZQUOIL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NS(=O)(=O)c1ccsc1C(=O)O
Properties
Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.013g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.343g/mol
Monoisotopic Mass:
297.013g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties