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119871-69-1 | 5,5'-Bi-1,2,4-oxadiazole, 3,3'-diphenyl-
CAS No: 119871-69-1 Catalog No: AG000PSP MDL No:
Product Description
Catalog Number:
AG000PSP
Chemical Name:
5,5'-Bi-1,2,4-oxadiazole, 3,3'-diphenyl-
CAS Number:
119871-69-1
Molecular Formula:
C16H10N4O2
Molecular Weight:
290.2762
IUPAC Name:
3-phenyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-1,2,4-oxadiazole
InChI:
InChI=1S/C16H10N4O2/c1-3-7-11(8-4-1)13-17-15(21-19-13)16-18-14(20-22-16)12-9-5-2-6-10-12/h1-10H
InChI Key:
RMQDUADKTVOZCR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1noc(n1)c1onc(n1)c1ccccc1
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.08g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.282g/mol
Monoisotopic Mass:
290.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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