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83959-73-3 | Oxazole, 5-[1,1'-biphenyl]-4-yl-2-[4-(1,1-dimethylethyl)phenyl]-
CAS No: 83959-73-3 Catalog No: AG004R55 MDL No:
Product Description
Catalog Number:
AG004R55
Chemical Name:
Oxazole, 5-[1,1'-biphenyl]-4-yl-2-[4-(1,1-dimethylethyl)phenyl]-
CAS Number:
83959-73-3
Molecular Formula:
C25H23NO
Molecular Weight:
353.4562
IUPAC Name:
2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3-oxazole
InChI:
InChI=1S/C25H23NO/c1-25(2,3)22-15-13-21(14-16-22)24-26-17-23(27-24)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-17H,1-3H3
InChI Key:
HAHQHPTTZPWACC-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)c1ncc(o1)c1ccc(cc1)c1ccccc1)(C)C
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.178g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.465g/mol
Monoisotopic Mass:
353.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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