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20746-23-0 | Phosphonium, bis(4-methylphenyl)diphenyl-, bromide (1:1)
CAS No: 20746-23-0 Catalog No: AG002J2K MDL No:
Product Description
Catalog Number:
AG002J2K
Chemical Name:
Phosphonium, bis(4-methylphenyl)diphenyl-, bromide (1:1)
CAS Number:
20746-23-0
Molecular Formula:
C26H24BrP
Molecular Weight:
447.3465
IUPAC Name:
bis(4-methylphenyl)-diphenylphosphanium;chloride
InChI:
InChI=1S/C26H24P.ClH/c1-21-13-17-25(18-14-21)27(23-9-5-3-6-10-23,24-11-7-4-8-12-24)26-19-15-22(2)16-20-26;/h3-20H,1-2H3;1H/q+1;/p-1
InChI Key:
SLBVPKNKQUVDKK-UHFFFAOYSA-M
SMILES:
Cc1ccc(cc1)[P+](c1ccc(cc1)C)(c1ccccc1)c1ccccc1.[Br-]
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.13g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.902g/mol
Monoisotopic Mass:
402.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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