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151426-53-8 | 1,3,4-Oxadiazole, 2,5-bis(4-phenoxyphenyl)-
CAS No: 151426-53-8 Catalog No: AG001NC1 MDL No:
Product Description
Catalog Number:
AG001NC1
Chemical Name:
1,3,4-Oxadiazole, 2,5-bis(4-phenoxyphenyl)-
CAS Number:
151426-53-8
Molecular Formula:
C26H18N2O3
Molecular Weight:
406.4327
IUPAC Name:
2,5-bis(4-phenoxyphenyl)-1,3,4-oxadiazole
InChI:
InChI=1S/C26H18N2O3/c1-3-7-21(8-4-1)29-23-15-11-19(12-16-23)25-27-28-26(31-25)20-13-17-24(18-14-20)30-22-9-5-2-6-10-22/h1-18H
InChI Key:
OMTSIYZBDVQLOH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Oc1ccc(cc1)c1nnc(o1)c1ccc(cc1)Oc1ccccc1
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.132g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
406.441g/mol
Monoisotopic Mass:
406.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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