Home Sulfos 6-methanesulfonamidopyridine-3-carboxylic acid

6-methanesulfonamidopyridine-3-carboxylic acid

CAS No.:
960324-86-1
Catalog Number:
AG01B7CK
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
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Product Description
Catalog Number:
AG01B7CK
Chemical Name:
6-methanesulfonamidopyridine-3-carboxylic acid
CAS Number:
960324-86-1
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
MDL Number:
MFCD14619235
IUPAC Name:
6-(methanesulfonamido)pyridine-3-carboxylic acid
InChI:
InChI=1S/C7H8N2O4S/c1-14(12,13)9-6-3-2-5(4-8-6)7(10)11/h2-4H,1H3,(H,8,9)(H,10,11)
InChI Key:
NCLLBFUFTPPKAP-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(nc1)NS(=O)(=O)C
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties