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89822-56-0 | Phosphonium, [(3-formylphenyl)methyl]triphenyl-, bromide
CAS No: 89822-56-0 Catalog No: AG003Z5V MDL No:
Product Description
Catalog Number:
AG003Z5V
Chemical Name:
Phosphonium, [(3-formylphenyl)methyl]triphenyl-, bromide
CAS Number:
89822-56-0
Molecular Formula:
C26H22BrOP
Molecular Weight:
461.3300
IUPAC Name:
(3-formylphenyl)methyl-triphenylphosphanium;bromide
InChI:
InChI=1S/C26H22OP.BrH/c27-20-22-11-10-12-23(19-22)21-28(24-13-4-1-5-14-24,25-15-6-2-7-16-25)26-17-8-3-9-18-26;/h1-20H,21H2;1H/q+1;/p-1
InChI Key:
TUWMQWDQTNBDOI-UHFFFAOYSA-M
SMILES:
O=Cc1cccc(c1)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
460.059g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
461.339g/mol
Monoisotopic Mass:
460.059g/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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