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148461-15-8 | (S)-(+)-2-[2-(Diphenylphosphino)phenyl]-4-phenyl-2-oxazoline
CAS No: 148461-15-8 Catalog No: AG003CG6 MDL No:MFCD01863026
Product Description
Catalog Number:
AG003CG6
Chemical Name:
(S)-(+)-2-[2-(Diphenylphosphino)phenyl]-4-phenyl-2-oxazoline
CAS Number:
148461-15-8
Molecular Formula:
C27H22NOP
Molecular Weight:
407.4434
MDL Number:
MFCD01863026
IUPAC Name:
diphenyl-[2-[(4S)-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/t25-/m1/s1
InChI Key:
OKUTYUNUKKPYJS-RUZDIDTESA-N
SMILES:
c1ccc(cc1)[C@H]1COC(=N1)c1ccccc1P(c1ccccc1)c1ccccc1
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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