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88059-55-6 | Pyridine, 4-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-
CAS No: 88059-55-6 Catalog No: AG004FGB MDL No:
Product Description
Catalog Number:
AG004FGB
Chemical Name:
Pyridine, 4-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-
CAS Number:
88059-55-6
Molecular Formula:
C14H11N3O
Molecular Weight:
237.2566
IUPAC Name:
5-(2-methylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C14H11N3O/c1-10-4-2-3-5-12(10)14-16-13(17-18-14)11-6-8-15-9-7-11/h2-9H,1H3
InChI Key:
GJUVZJBNOGUNHT-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1onc(n1)c1ccncc1
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.262g/mol
Monoisotopic Mass:
237.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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