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189169-55-9 | Oxazole, 2-[2-(diphenylphosphino)phenyl]-4,5-dihydro-4-phenyl-
CAS No: 189169-55-9 Catalog No: AG002HZA MDL No:
Product Description
Catalog Number:
AG002HZA
Chemical Name:
Oxazole, 2-[2-(diphenylphosphino)phenyl]-4,5-dihydro-4-phenyl-
CAS Number:
189169-55-9
Molecular Formula:
C27H22NOP
Molecular Weight:
407.4434
IUPAC Name:
diphenyl-[2-(4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]phosphane
InChI:
InChI=1S/C27H22NOP/c1-4-12-21(13-5-1)25-20-29-27(28-25)24-18-10-11-19-26(24)30(22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-19,25H,20H2
InChI Key:
OKUTYUNUKKPYJS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1COC(=N1)c1ccccc1P(c1ccccc1)c1ccccc1
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.144g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.453g/mol
Monoisotopic Mass:
407.144g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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