Home Sulfos 2-(Phenylsulfonyl)nicotinaldehyde

2-(Phenylsulfonyl)nicotinaldehyde

CAS No.:
1161864-92-1
Catalog Number:
AG019EV3
Molecular Formula:
C12H9NO3S
Molecular Weight:
247.2698
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$168
- +
250mg
95%
In Stock USA
United States
$294
- +
1g
95%
In Stock USA
United States
$588
- +
Product Description
Catalog Number:
AG019EV3
Chemical Name:
2-(Phenylsulfonyl)nicotinaldehyde
CAS Number:
1161864-92-1
Molecular Formula:
C12H9NO3S
Molecular Weight:
247.2698
MDL Number:
MFCD29917041
IUPAC Name:
2-(benzenesulfonyl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C12H9NO3S/c14-9-10-5-4-8-13-12(10)17(15,16)11-6-2-1-3-7-11/h1-9H
InChI Key:
LENIWDMRUJFJDE-UHFFFAOYSA-N
SMILES:
O=Cc1cccnc1S(=O)(=O)c1ccccc1
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.03g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.268g/mol
Monoisotopic Mass:
247.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties