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14479-52-8 | Phosphonium, bis(2-methylphenyl)phenyl(phenylmethyl)-, chloride (1:1)
CAS No: 14479-52-8 Catalog No: AG001K5Y MDL No:
Product Description
Catalog Number:
AG001K5Y
Chemical Name:
Phosphonium, bis(2-methylphenyl)phenyl(phenylmethyl)-, chloride (1:1)
CAS Number:
14479-52-8
Molecular Formula:
C27H26ClP
Molecular Weight:
416.9221
IUPAC Name:
benzyl-bis(2-methylphenyl)-phenylphosphanium
InChI:
InChI=1S/C27H26P/c1-22-13-9-11-19-26(22)28(25-17-7-4-8-18-25,21-24-15-5-3-6-16-24)27-20-12-10-14-23(27)2/h3-20H,21H2,1-2H3/q+1
InChI Key:
GSTZOQQDCFUSOC-UHFFFAOYSA-N
SMILES:
Cc1ccccc1[P+](c1ccccc1C)(c1ccccc1)Cc1ccccc1.[Cl-]
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.177g/mol
Formal Charge:
1
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.479g/mol
Monoisotopic Mass:
381.177g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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