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201161-15-1 | Phosphonium, 1-propene-1,3-diylbis[triphenyl-, dibromide (9CI)
CAS No: 201161-15-1 Catalog No: AG002D88 MDL No:
Product Description
Catalog Number:
AG002D88
Chemical Name:
Phosphonium, 1-propene-1,3-diylbis[triphenyl-, dibromide (9CI)
CAS Number:
201161-15-1
Molecular Formula:
C39H34Br2P2
Molecular Weight:
724.4428
IUPAC Name:
triphenyl(3-triphenylphosphaniumylprop-1-enyl)phosphanium;dibromide
InChI:
InChI=1S/C39H34P2.2BrH/c1-7-20-34(21-8-1)40(35-22-9-2-10-23-35,36-24-11-3-12-25-36)32-19-33-41(37-26-13-4-14-27-37,38-28-15-5-16-29-38)39-30-17-6-18-31-39;;/h1-32H,33H2;2*1H/q+2;;/p-2
InChI Key:
PHTBXJRAENVVLO-UHFFFAOYSA-L
SMILES:
c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)CC=C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-].[Br-]
Properties
Complexity:
674
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
724.048g/mol
Formal Charge:
0
Heavy Atom Count:
43
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
724.457g/mol
Monoisotopic Mass:
722.05g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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