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306935-20-6 | Pyridine, 2-[[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]sulfonyl]-
CAS No: 306935-20-6 Catalog No: AG0030UW MDL No:
Product Description
Catalog Number:
AG0030UW
Chemical Name:
Pyridine, 2-[[[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]methyl]sulfonyl]-
CAS Number:
306935-20-6
Molecular Formula:
C9H8ClN3O3S
Molecular Weight:
273.6961
IUPAC Name:
5-(chloromethyl)-3-(pyridin-2-ylsulfonylmethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C9H8ClN3O3S/c10-5-8-12-7(13-16-8)6-17(14,15)9-3-1-2-4-11-9/h1-4H,5-6H2
InChI Key:
MFEGTJBBLPXXDT-UHFFFAOYSA-N
SMILES:
ClCc1onc(n1)CS(=O)(=O)c1ccccn1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.997g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.691g/mol
Monoisotopic Mass:
272.997g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
94.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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