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24425-12-5 | Phosphonium, (1,1-dimethyl-2-oxo-2-phenylethyl)triphenyl-, iodide
CAS No: 24425-12-5 Catalog No: AG007NAB MDL No:
Product Description
Catalog Number:
AG007NAB
Chemical Name:
Phosphonium, (1,1-dimethyl-2-oxo-2-phenylethyl)triphenyl-, iodide
CAS Number:
24425-12-5
Molecular Formula:
C28H26IOP
Molecular Weight:
536.3837
IUPAC Name:
(2-methyl-1-oxo-1-phenylpropan-2-yl)-triphenylphosphanium;iodide
InChI:
InChI=1S/C28H26OP.HI/c1-28(2,27(29)23-15-7-3-8-16-23)30(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26;/h3-22H,1-2H3;1H/q+1;/p-1
InChI Key:
HGMVFFQUDRVGCI-UHFFFAOYSA-M
SMILES:
O=C(C([P+](c1ccccc1)(c1ccccc1)c1ccccc1)(C)C)c1ccccc1.[I-]
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.077g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
536.393g/mol
Monoisotopic Mass:
536.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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