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(Methoxymethyl)diphenylphosphine oxide

Catalog Number
ACM4455770
Product Name
(Methoxymethyl)diphenylphosphine oxide
Structure
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CAS
4455-77-0
  • Product Overview
  • Usage
Synonyms
Diphenyl(Methoxymethyl)Phosphine Oxide
IUPAC Name
[methoxymethyl(phenyl)phosphoryl]benzene
Molecular Weight
246.25
Molecular Formula
C14H15O2P
Canonical SMILES
COCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2;
InChI
OEPKDBQOTLDTNC-UHFFFAOYSA-N
InChI Key
InChI=1S/C14H15O2P/c1-16-12-17(15,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3
Boiling Point
334.7±25.0 °C(Predicted)
Melting Point
115-117 °C(lit.)
Purity
98%
Density
1.14±0.1 g/cm3(Predicted)
Appearance
Solid
Complexity
243
Covalently-Bonded Unit Count
1
EC Number
224-704-4
Exact Mass
246.081g/mol
H-Bond Acceptor
2
Heavy Atom Count
17
Isomeric SMILES
COCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Monoisotopic Mass
246.081g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
26.3A^2
Undefined Atom Stereocenter Count
1
Application
(Methoxymethyl)diphenylphosphine oxide is a catalyst presented as a white to pale yellow crystalline powder, designed to facilitate specific chemical reactions. It serves an essential role in the Molybdenum hexacarbonyl-mediated Pauson-Khand reactions and also enhances the efficiency of Rhodium-catalyzed hydroformylation reactions, making it a valuable component in advanced synthetic processes.
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