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89243-82-3

89243-82-3 | Phosphine, (1,8-dioxo-1,8-octanediyl)bis[diphenyl-

CAS No: 89243-82-3 Catalog No: AG0042J3 MDL No:

Product Description

Catalog Number:
AG0042J3
Chemical Name:
Phosphine, (1,8-dioxo-1,8-octanediyl)bis[diphenyl-
CAS Number:
89243-82-3
Molecular Formula:
C32H32O2P2
Molecular Weight:
510.5428
IUPAC Name:
1,8-bis(diphenylphosphanyl)octane-1,8-dione
InChI:
InChI=1S/C32H32O2P2/c33-31(35(27-17-7-3-8-18-27)28-19-9-4-10-20-28)25-15-1-2-16-26-32(34)36(29-21-11-5-12-22-29)30-23-13-6-14-24-30/h3-14,17-24H,1-2,15-16,25-26H2
InChI Key:
MLYIACQPFRYVQE-UHFFFAOYSA-N
SMILES:
O=C(P(c1ccccc1)c1ccccc1)CCCCCCC(=O)P(c1ccccc1)c1ccccc1

Properties

Complexity:
549  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
510.188g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
510.554g/mol
Monoisotopic Mass:
510.188g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1  

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