Home Sulfos 1-[Phenyl(sulfonato)methyl]pyridin-1-ium

1-[Phenyl(sulfonato)methyl]pyridin-1-ium

CAS No.:
83283-97-0
Catalog Number:
AG01EXLD
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
96%
1 week
United States
$263
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Product Description
Catalog Number:
AG01EXLD
Chemical Name:
1-[Phenyl(sulfonato)methyl]pyridin-1-ium
CAS Number:
83283-97-0
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
MDL Number:
MFCD00957467
IUPAC Name:
phenyl(pyridin-1-ium-1-yl)methanesulfonate
InChI:
InChI=1S/C12H11NO3S/c14-17(15,16)12(11-7-3-1-4-8-11)13-9-5-2-6-10-13/h1-10,12H
InChI Key:
NESWJVQPPBKTAS-UHFFFAOYSA-N
SMILES:
[O-]S(=O)(=O)C([n+]1ccccc1)c1ccccc1
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.284g/mol
Monoisotopic Mass:
249.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties