Diphenyl(2-methoxyphenyl)phosphine

• CAS: 53111-20-9
• Catalog Number: ACM53111209-1
• Category: Other Products
• Molecular Weight: 292.31
• Molecular Formula: C19H17OP
• Synonyms: (O-Methoxyphenyl)Diphenylphosphine; Diphenyl(O-Methoxyphenyl)Phosphine
• IUPAC Name: (2-methoxyphenyl)-diphenylphosphane
• SMILES: COC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3
• InChI: GBXNVYBGIFEOEM-UHFFFAOYSA-N
• InChI Key: InChI=1S/C19H17OP/c1-20-18-14-8-9-15-19(18)21(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3
• Melting Point: 124-126 °C(lit.)
• Complexity: 276
• Covalently-Bonded Unit Count: 1
• Exact Mass: 292.102g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 21
• Isomeric SMILES: COC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3
• Monoisotopic Mass: 292.102g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 9.2A^2

Custom Q&A

What is the IUPAC name of the compound with the CAS number 53111-20-9?

The IUPAC name is (2-methoxyphenyl)-diphenylphosphane.

What is the molecular formula of the compound Diphenyl(2-methoxyphenyl)phosphine?

The molecular formula is C19H17OP.

What is the exact mass of Diphenyl(2-methoxyphenyl)phosphine?

The exact mass is 292.101702159 g/mol.

How many hydrogen bond acceptors does Diphenyl(2-methoxyphenyl)phosphine have?

It has 1 hydrogen bond acceptor.

What is the Canonical SMILES notation for Diphenyl(2-methoxyphenyl)phosphine?

The Canonical SMILES notation is COC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3.

How many heavy atoms are present in the compound Diphenyl(2-methoxyphenyl)phosphine?

There are 21 heavy atoms.

What is the XLogP3 value of Diphenyl(2-methoxyphenyl)phosphine?

The XLogP3 value is 4.6.

What is the InChIKey for Diphenyl(2-methoxyphenyl)phosphine?

The InChIKey is GBXNVYBGIFEOEM-UHFFFAOYSA-N.

What is the mono-isotopic mass of Diphenyl(2-methoxyphenyl)phosphine?

The mono-isotopic mass is 292.101702159 g/mol.

Synthetic Use

Downstream Synthesis Route 1

• 53111-20-9

• 103661-65-0

Reference: [1]Shvets, A. A.; Popov, L. D.; Kogan, V. A.; Litvinov, V. V.; Etmetchenko, L. N.
[Journal of general chemistry of the USSR, 1988, vol. 58, # 5, p. 928 - 930][Zhurnal Obshchei Khimii, 1988, vol. 58, # 5, p. 1046 - 1049]
[2]Muller, Alfred; Otto, Stefanus; Roodt, Andreas
[Dalton Transactions, 2008, # 5, p. 650 - 657]

Downstream Synthesis Route 2

• 53111-20-9

• 829-85-6

Reference: [1]Doorn, Johannes A. van; Frijns, John H. G.; Meijboom, Nico
[Recueil des Travaux Chimiques des Pays-Bas, 1991, vol. 110, # 11, p. 441 - 449]

* For details of the synthesis route, please refer to the original source to ensure accuracy.