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83959-82-4 | Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(3-methylphenyl)-
CAS No: 83959-82-4 Catalog No: AG0052S5 MDL No:
Product Description
Catalog Number:
AG0052S5
Chemical Name:
Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(3-methylphenyl)-
CAS Number:
83959-82-4
Molecular Formula:
C22H17NO
Molecular Weight:
311.3765
IUPAC Name:
2-(3-methylphenyl)-5-(4-phenylphenyl)-1,3-oxazole
InChI:
InChI=1S/C22H17NO/c1-16-6-5-9-20(14-16)22-23-15-21(24-22)19-12-10-18(11-13-19)17-7-3-2-4-8-17/h2-15H,1H3
InChI Key:
LGOWJQHJUUYSQU-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)c1ncc(o1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.131g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.384g/mol
Monoisotopic Mass:
311.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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