2- Diphenylphosphino formaldehyde

• CAS: 50777-76-9
• Catalog Number: ACM50777769-2
• Category: Other Phosphine Ligands
• Molecular Weight: 290.30
• Molecular Formula: C19H15OP
• Synonyms: CS-W014553; SCHEMBL705407; N057; AN-41434; 777D769; RTC-020460; BP-12624; D4411; OR322260; 2-(diphenylphosphanyl)benzaldehyde
• IUPAC Name: 2-Diphenylphosphanylbenzaldehyde
• SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C=O
• InChI: InChI=1S/C19H15OP/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H
• InChI Key: DRCPJRZHAJMWOU-UHFFFAOYSA-N
• Application: suzuki reaction
• Complexity: 300
• Covalently-Bonded Unit Count: 1
• Exact Mass: 290.086g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 21
• Monoisotopic Mass: 290.086g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 17.1A^2

Custom Q&A

What is the molecular formula of 2-diphenylphosphino formaldehyde?

The molecular formula is C19H15OP.

What is the molecular weight of 2-diphenylphosphino formaldehyde?

The molecular weight is 290.3 g/mol.

How is the IUPAC name of 2-diphenylphosphino formaldehyde computed?

The IUPAC name is computed as 2-diphenylphosphanylbenzaldehyde.

What is the InChI of 2-diphenylphosphino formaldehyde?

The InChI is "InChI=1S/C19H15OP/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H".

What is the InChIKey of 2-diphenylphosphino formaldehyde?

The InChIKey is "DRCPJRZHAJMWOU-UHFFFAOYSA-N".

What is the canonical SMILES of 2-diphenylphosphino formaldehyde?

The canonical SMILES is "C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C=O".

What is the CAS number of 2-diphenylphosphino formaldehyde?

The CAS number is 50777-76-9.

What is the European Community (EC) number of 2-diphenylphosphino formaldehyde?

The EC number is 627-711-4.

What is the UNII of 2-diphenylphosphino formaldehyde?

The UNII is 5M9BQ2FEC8.

What is the molecular weight and XLogP3-AA value of 2-diphenylphosphino formaldehyde?

The molecular weight is 290.3 g/mol and the XLogP3-AA value is 4.1.

Synthetic Use

Upstream Synthesis Route 1

• 6630-33-7
• 829-85-6

• 50777-76-9

Reference: [1] Advanced Synthesis and Catalysis, 2001, vol. 343, # 6-7, p. 711 - 720
[2] Chemistry - A European Journal, 2015, vol. 21, # 36, p. 12735 - 12740
[3] Chemistry of Materials, 2016, vol. 28, # 19, p. 7145 - 7157

Upstream Synthesis Route 2

• 143024-49-1

• 50777-76-9

Reference: [1] Organic Letters, 2014, vol. 16, # 2, p. 390 - 393

Upstream Synthesis Route 3

• 68-12-2
• 62336-24-7

• 50777-76-9

Reference: [1] Organic Letters, 2007, vol. 9, # 22, p. 4571 - 4574
[2] Organic and Biomolecular Chemistry, 2006, vol. 4, # 3, p. 544 - 550

Downstream Synthesis Route 1

• 50777-76-9

• 81073-06-5

Reference: [1]Battilocchio, Claudio; Hawkins, Joel M.; Ley, Steven V.
[Organic Letters, 2013, vol. 15, # 9, p. 2278 - 2281]

Downstream Synthesis Route 2

• 50777-76-9

• 153358-05-5

Reference: [1]Nikitidis, Antonios; Andersson, Carlaxel
[Phosphorus, Sulfur and Silicon and the Related Elements, 1993, vol. 78, # 1-4, p. 141 - 152]
[2]Altan, Orhan
[Applied Organometallic Chemistry, 2022, vol. 36, # 6]
[3]Xu, Lei; Zhu, Di; Wu, Fan; Wang, Rongliang; Wan, Boshun
[Tetrahedron, 2005, vol. 61, # 27, p. 6553 - 6560]

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