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69442-52-0 | Phosphonium, triphenyl[1-(phenylthio)ethenyl]-, iodide
CAS No: 69442-52-0 Catalog No: AG005M36 MDL No:
Product Description
Catalog Number:
AG005M36
Chemical Name:
Phosphonium, triphenyl[1-(phenylthio)ethenyl]-, iodide
CAS Number:
69442-52-0
Molecular Formula:
C26H22IPS
Molecular Weight:
524.3961
IUPAC Name:
triphenyl(1-phenylsulfanylethenyl)phosphanium;iodide
InChI:
InChI=1S/C26H22PS.HI/c1-22(28-26-20-12-5-13-21-26)27(23-14-6-2-7-15-23,24-16-8-3-9-17-24)25-18-10-4-11-19-25;/h2-21H,1H2;1H/q+1;/p-1
InChI Key:
BJPSYGCZHLDZOE-UHFFFAOYSA-M
SMILES:
C=C([P+](c1ccccc1)(c1ccccc1)c1ccccc1)Sc1ccccc1.[I-]
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
524.022g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
524.4g/mol
Monoisotopic Mass:
524.022g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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