2-(Dicyclohexylphosphino)biphenyl

• Catalog Number: ACM247940063-1
• Product Name: 2-(Dicyclohexylphosphino)biphenyl
• CAS: 247940-06-3
• Category: Organic Phosphine Compounds
• Synonyms: Cyclohexyl JohnPhos
• IUPAC Name: dicyclohexyl-(2-phenylphenyl)phosphane
• Molecular Weight: 350.48
• Molecular Formula: C24H31P
• Canonical SMILES: C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3C4=CC=CC=C4
• InChI: LCSNDSFWVKMJCT-UHFFFAOYSA-N
• InChI Key: InChI=1S/C24H31P/c1-4-12-20(13-5-1)23-18-10-11-19-24(23)25(21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1,4-5,10-13,18-19,21-22H,2-3,6-9,14-17H2
• Boiling Point: 499.5±24.0 °C(Predicted)
• Melting Point: 102-106 °C(lit.)
• Appearance: Solid
• Application: Ligand used in the palladium-catalyzed synthesis of aromatic amines from aryl chlorides, bromides and triflates.; ; Ligand employed in Suzuki coupling reactions involving aryl chlorides, bromides and triflates.; ; Useful ligand for the Pd-catalyzed oxidation of alcohols in the presence of chlorobenzenes.; ; Useful ligand for the Pd-catalyzed amination with ammonia equivalents.; ; Ligand for the gold(I)-catalyzed intramolecular [4+2] cycloadditions involving 1,3-enynes and arylalkynes with alkenes.; ; Ligand used in the palladium-catalyzed borylation of aryl bromdies.; ; Ligand used in the palladium-catalyzed siliylation of aryl chlorides.
• Complexity: 356
• Covalently-Bonded Unit Count: 1
• EC Number: 480-030-2
• Exact Mass: 350.216g/mol
• Heavy Atom Count: 25
• Isomeric SMILES: C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3C4=CC=CC=C4
• Monoisotopic Mass: 350.216g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 0A^2

Custom Q&A

What is the molecular formula of 2-(Dicyclohexylphosphino)biphenyl?

The molecular formula of 2-(Dicyclohexylphosphino)biphenyl is C24H31P.

What is the molecular weight of 2-(Dicyclohexylphosphino)biphenyl?

The molecular weight of 2-(Dicyclohexylphosphino)biphenyl is 350.5 g/mol.

What is the IUPAC name of 2-(Dicyclohexylphosphino)biphenyl?

The IUPAC name of 2-(Dicyclohexylphosphino)biphenyl is dicyclohexyl-(2-phenylphenyl)phosphane.

What is the Canonical SMILES representation of 2-(Dicyclohexylphosphino)biphenyl?

The Canonical SMILES representation of 2-(Dicyclohexylphosphino)biphenyl is C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3C4=CC=CC=C4.

What is the InChIKey of 2-(Dicyclohexylphosphino)biphenyl?

The InChIKey of 2-(Dicyclohexylphosphino)biphenyl is LCSNDSFWVKMJCT-UHFFFAOYSA-N.

What is the CAS number of 2-(Dicyclohexylphosphino)biphenyl?

The CAS number of 2-(Dicyclohexylphosphino)biphenyl is 247940-06-3.

What is the European Community (EC) Number of 2-(Dicyclohexylphosphino)biphenyl?

The European Community (EC) Number of 2-(Dicyclohexylphosphino)biphenyl is 480-030-2.

What is the DSSTox Substance ID of 2-(Dicyclohexylphosphino)biphenyl?

The DSSTox Substance ID of 2-(Dicyclohexylphosphino)biphenyl is DTXSID60370170.

What is the XLogP3-AA value of 2-(Dicyclohexylphosphino)biphenyl?

The XLogP3-AA value of 2-(Dicyclohexylphosphino)biphenyl is 6.7.

How many rotatable bond counts does 2-(Dicyclohexylphosphino)biphenyl have?

2-(Dicyclohexylphosphino)biphenyl has 4 rotatable bond counts.