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78523-90-7 | 2(3H)-Oxazolone, 3-(4-methylphenyl)-4,5-diphenyl-
CAS No: 78523-90-7 Catalog No: AG008MKX MDL No:
Product Description
Catalog Number:
AG008MKX
Chemical Name:
2(3H)-Oxazolone, 3-(4-methylphenyl)-4,5-diphenyl-
CAS Number:
78523-90-7
Molecular Formula:
C22H17NO2
Molecular Weight:
327.3759
IUPAC Name:
3-(4-methylphenyl)-4,5-diphenyl-1,3-oxazol-2-one
InChI:
InChI=1S/C22H17NO2/c1-16-12-14-19(15-13-16)23-20(17-8-4-2-5-9-17)21(25-22(23)24)18-10-6-3-7-11-18/h2-15H,1H3
InChI Key:
WVTUVPYRTDTBJX-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1c(=O)oc(c1c1ccccc1)c1ccccc1
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.383g/mol
Monoisotopic Mass:
327.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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