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Home > Pyridines > 113823-83-9
113823-83-9 | 4-Pyridinecarboxamide, 2-chloro-N-(phenylsulfonyl)-
CAS No: 113823-83-9 Catalog No: AG0009ST MDL No:
Product Description
Catalog Number:
AG0009ST
Chemical Name:
4-Pyridinecarboxamide, 2-chloro-N-(phenylsulfonyl)-
CAS Number:
113823-83-9
Molecular Formula:
C12H9ClN2O3S
Molecular Weight:
296.7295
IUPAC Name:
N-(benzenesulfonyl)-2-chloropyridine-4-carboxamide
InChI:
InChI=1S/C12H9ClN2O3S/c13-11-8-9(6-7-14-11)12(16)15-19(17,18)10-4-2-1-3-5-10/h1-8H,(H,15,16)
InChI Key:
KSOYGIQTLKFLTM-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)C(=O)NS(=O)(=O)c1ccccc1
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.002g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.725g/mol
Monoisotopic Mass:
296.002g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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