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79428-94-7 | Phosphonium, [1,4-phenylenebis(methylene)]bis[tributyl-, dichloride
CAS No: 79428-94-7 Catalog No: AG005K3M MDL No:
Product Description
Catalog Number:
AG005K3M
Chemical Name:
Phosphonium, [1,4-phenylenebis(methylene)]bis[tributyl-, dichloride
CAS Number:
79428-94-7
Molecular Formula:
C32H62Cl2P2
Molecular Weight:
579.6882
IUPAC Name:
tributyl-[[4-(tributylphosphaniumylmethyl)phenyl]methyl]phosphanium;dichloride
InChI:
InChI=1S/C32H62P2.2ClH/c1-7-13-23-33(24-14-8-2,25-15-9-3)29-31-19-21-32(22-20-31)30-34(26-16-10-4,27-17-11-5)28-18-12-6;;/h19-22H,7-18,23-30H2,1-6H3;2*1H/q+2;;/p-2
InChI Key:
VXXRXAYLAUWBSK-UHFFFAOYSA-L
SMILES:
CCCC[P+](Cc1ccc(cc1)C[P+](CCCC)(CCCC)CCCC)(CCCC)CCCC.[Cl-].[Cl-]
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
578.37g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
579.696g/mol
Monoisotopic Mass:
578.37g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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