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137516-55-3

137516-55-3 | Phosphonium, (1-hydroxy-3-phenylpropyl)triphenyl-, chloride (1:1)

CAS No: 137516-55-3 Catalog No: AG0013GI MDL No:

Product Description

Catalog Number:
AG0013GI
Chemical Name:
Phosphonium, (1-hydroxy-3-phenylpropyl)triphenyl-, chloride (1:1)
CAS Number:
137516-55-3
Molecular Formula:
C27H26ClOP
Molecular Weight:
432.9215
IUPAC Name:
(1-hydroxy-3-phenylpropyl)-triphenylphosphanium;chloride
InChI:
InChI=1S/C27H26OP.ClH/c28-27(22-21-23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h1-20,27-28H,21-22H2;1H/q+1;/p-1
InChI Key:
QWQGUJMNYHISKH-UHFFFAOYSA-M
SMILES:
OC([P+](c1ccccc1)(c1ccccc1)c1ccccc1)CCc1ccccc1.[Cl-]

Properties

Complexity:
408  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
432.141g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
432.928g/mol
Monoisotopic Mass:
432.141g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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