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88682-53-5 | Phosphonium, [2-(diphenylphosphinyl)phenyl]methyldiphenyl-, bromide
CAS No: 88682-53-5 Catalog No: AG0047G4 MDL No:
Product Description
Catalog Number:
AG0047G4
Chemical Name:
Phosphonium, [2-(diphenylphosphinyl)phenyl]methyldiphenyl-, bromide
CAS Number:
88682-53-5
Molecular Formula:
C31H27BrOP2
Molecular Weight:
557.3970
IUPAC Name:
(2-diphenylphosphorylphenyl)methyl-diphenylphosphanium;bromide
InChI:
InChI=1S/C31H26OP2.BrH/c32-34(29-20-9-3-10-21-29,30-22-11-4-12-23-30)31-24-14-13-15-26(31)25-33(27-16-5-1-6-17-27)28-18-7-2-8-19-28;/h1-24H,25H2;1H
InChI Key:
LCZKPOGDJNOTAQ-UHFFFAOYSA-N
SMILES:
O=P(c1ccccc1C[PH+](c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
Properties
Complexity:
598
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.072g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
557.408g/mol
Monoisotopic Mass:
556.072g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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