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22884-31-7 | 1,5-Pentanediylbis(triphenylphosphonium) dibromide, 1,1'-(1,5-pentanediyl)bis[1,1,1-triphenyl-, bromide (1:2)
CAS No: 22884-31-7 Catalog No: AG002LCH MDL No:
Product Description
Catalog Number:
AG002LCH
Chemical Name:
1,5-Pentanediylbis(triphenylphosphonium) dibromide, 1,1'-(1,5-pentanediyl)bis[1,1,1-triphenyl-, bromide (1:2)
CAS Number:
22884-31-7
Molecular Formula:
C41H40Br2P2
Molecular Weight:
754.5118
IUPAC Name:
triphenyl(5-triphenylphosphaniumylpentyl)phosphanium;dibromide
InChI:
InChI=1S/C41H40P2.2BrH/c1-8-22-36(23-9-1)42(37-24-10-2-11-25-37,38-26-12-3-13-27-38)34-20-7-21-35-43(39-28-14-4-15-29-39,40-30-16-5-17-31-40)41-32-18-6-19-33-41;;/h1-6,8-19,22-33H,7,20-21,34-35H2;2*1H/q+2;;/p-2
InChI Key:
XIZMFZWZYVQIOX-UHFFFAOYSA-L
SMILES:
C(CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-].[Br-]
EC Number:
245-292-2
Properties
Complexity:
600
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
754.095g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
754.527g/mol
Monoisotopic Mass:
752.097g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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