Home Halogens 2-(tert-butylsulfamoyl)-5-chlorothiophene-3-carboxylic acid

2-(tert-butylsulfamoyl)-5-chlorothiophene-3-carboxylic acid

CAS No.:
155731-15-0
Catalog Number:
AG01BHKP
Molecular Formula:
C9H12ClNO4S2
Molecular Weight:
297.7789
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Product Description
Catalog Number:
AG01BHKP
Chemical Name:
2-(tert-butylsulfamoyl)-5-chlorothiophene-3-carboxylic acid
CAS Number:
155731-15-0
Molecular Formula:
C9H12ClNO4S2
Molecular Weight:
297.7789
MDL Number:
MFCD28145302
IUPAC Name:
2-(tert-butylsulfamoyl)-5-chlorothiophene-3-carboxylic acid
InChI:
InChI=1S/C9H12ClNO4S2/c1-9(2,3)11-17(14,15)8-5(7(12)13)4-6(10)16-8/h4,11H,1-3H3,(H,12,13)
InChI Key:
AAGPMZWZIZWWFA-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(sc1S(=O)(=O)NC(C)(C)C)Cl
Properties
Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.99g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.768g/mol
Monoisotopic Mass:
296.99g/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