Di(1-adamantyl)benzylphosphine

• Catalog Number: ACM395116708-1
• Product Name: Di(1-adamantyl)benzylphosphine
• CAS: 395116-70-8
• Category: Organic Phosphine Compounds
• Synonyms: Benzyldi-1-Adamantylphosphine
• IUPAC Name: bis(1-adamantyl)-benzylphosphane
• Molecular Weight: 392.56
• Molecular Formula: C27H37P
• Canonical SMILES: C1C2CC3CC1CC(C2)(C3)P(CC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6
• InChI: ANIAFEJRWQDKDV-UHFFFAOYSA-N
• InChI Key: InChI=1S/C27H37P/c1-2-4-19(5-3-1)18-28(26-12-20-6-21(13-26)8-22(7-20)14-26)27-15-23-9-24(16-27)11-25(10-23)17-27/h1-5,20-25H,6-18H2
• Melting Point: 183 °C
• Appearance: Solid
• Application: Useful ligand for Sonogashira coupling reaction.
• Complexity: 487
• Covalently-Bonded Unit Count: 1
• Exact Mass: 392.263g/mol
• Heavy Atom Count: 28
• Isomeric SMILES: C1C2CC3CC1CC(C2)(C3)P(CC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6
• Monoisotopic Mass: 392.263g/mol
• Rotatable Bond Count: 4
• Topological Polar Surface Area: 0A^2
• Type: cataCXium

Custom Q&A

What is the CAS number of Di(1-adamantyl)benzylphosphine?

The CAS number of Di(1-adamantyl)benzylphosphine is 395116-70-8.

How many heavy atoms are present in the molecular formula of Di(1-adamantyl)benzylphosphine?

There are 28 heavy atoms present in the molecular formula of Di(1-adamantyl)benzylphosphine.

What is the Canonical SMILES representation of Di(1-adamantyl)benzylphosphine?

The Canonical SMILES of Di(1-adamantyl)benzylphosphine is C1C2CC3CC1CC(C2)(C3)P(CC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6.

How many rotatable bonds are present in the structure of Di(1-adamantyl)benzylphosphine?

There are four rotatable bonds present in the structure of Di(1-adamantyl)benzylphosphine.

What is the molecular weight of Di(1-adamantyl)benzylphosphine?

The molecular weight of Di(1-adamantyl)benzylphosphine is 392.6g/mol.

What is the IUPAC name of Di(1-adamantyl)benzylphosphine?

The IUPAC name of Di(1-adamantyl)benzylphosphine is bis(1-adamantyl)-benzylphosphane.

What is the exact mass of Di(1-adamantyl)benzylphosphine?

The exact mass of Di(1-adamantyl)benzylphosphine is 392.263288178.

How many Covalently-Bonded Unit Count exist in Di(1-adamantyl)benzylphosphine?

There is one Covalently-Bonded Unit Count in Di(1-adamantyl)benzylphosphine.

What is the XLogP3 value of Di(1-adamantyl)benzylphosphine?

The XLogP3 value of Di(1-adamantyl)benzylphosphine is 6.8.

How many Isotope Atom Count are present in Di(1-adamantyl)benzylphosphine?

There are no Isotope Atom Count present in Di(1-adamantyl)benzylphosphine.