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123739-96-8 | Phosphine, 1,1',1''-(1,3,5-benzenetriyl)tris[1,1-diphenyl-
CAS No: 123739-96-8 Catalog No: AG000L13 MDL No:
Product Description
Catalog Number:
AG000L13
Chemical Name:
Phosphine, 1,1',1''-(1,3,5-benzenetriyl)tris[1,1-diphenyl-
CAS Number:
123739-96-8
Molecular Formula:
C42H33P3
Molecular Weight:
630.6327
IUPAC Name:
[3,5-bis(diphenylphosphanyl)phenyl]-diphenylphosphane
InChI:
InChI=1S/C42H33P3/c1-7-19-34(20-8-1)43(35-21-9-2-10-22-35)40-31-41(44(36-23-11-3-12-24-36)37-25-13-4-14-26-37)33-42(32-40)45(38-27-15-5-16-28-38)39-29-17-6-18-30-39/h1-33H
InChI Key:
AZUMLSBAMDLVIH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)P(c1ccccc1)c1cc(cc(c1)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
Properties
Complexity:
648
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
630.18g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
630.647g/mol
Monoisotopic Mass:
630.18g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10
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