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54770-27-3 | Ethene-1,2-diylbis(triphenylphosphonium) bromide
CAS No: 54770-27-3 Catalog No: AG003DFK MDL No:
Product Description
Catalog Number:
AG003DFK
Chemical Name:
Ethene-1,2-diylbis(triphenylphosphonium) bromide
CAS Number:
54770-27-3
Molecular Formula:
C38H32Br2P2
Molecular Weight:
710.4162
IUPAC Name:
triphenyl-[(E)-2-triphenylphosphaniumylethenyl]phosphanium;dibromide
InChI:
InChI=1S/C38H32P2.2BrH/c1-7-19-33(20-8-1)39(34-21-9-2-10-22-34,35-23-11-3-12-24-35)31-32-40(36-25-13-4-14-26-36,37-27-15-5-16-28-37)38-29-17-6-18-30-38;;/h1-32H;2*1H/q+2;;/p-2/b32-31+;;
InChI Key:
TVFYBHGFLHYJNV-GLDAUVFXSA-L
SMILES:
c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)/C=C/[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-].[Br-]
EC Number:
259-334-2
Properties
Complexity:
595
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
710.033g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
710.43g/mol
Monoisotopic Mass:
708.035g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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