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89262-45-3 | Phosphonium, [(4-acetylphenyl)methyl]triphenyl-, iodide
CAS No: 89262-45-3 Catalog No: AG0041H0 MDL No:
Product Description
Catalog Number:
AG0041H0
Chemical Name:
Phosphonium, [(4-acetylphenyl)methyl]triphenyl-, iodide
CAS Number:
89262-45-3
Molecular Formula:
C27H24IOP
Molecular Weight:
522.3571
IUPAC Name:
(4-acetylphenyl)methyl-triphenylphosphanium;iodide
InChI:
InChI=1S/C27H24OP.HI/c1-22(28)24-19-17-23(18-20-24)21-29(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27;/h2-20H,21H2,1H3;1H/q+1;/p-1
InChI Key:
BAQNAKKBPKUXIW-UHFFFAOYSA-M
SMILES:
CC(=O)c1ccc(cc1)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
522.061g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
522.366g/mol
Monoisotopic Mass:
522.061g/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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