Diphenyl(cyclohexyl)phosphine oxide

• Catalog Number: ACM13689208-1
• Product Name: Diphenyl(cyclohexyl)phosphine oxide
• CAS: 13689-20-8
• Category: Organic Phosphine Compounds
• Synonyms: Cyclohexyldiphenylphosphine Oxide
• IUPAC Name: [cyclohexyl(phenyl)phosphoryl]benzene
• Molecular Weight: 284.34
• Molecular Formula: C18H21OP
• Canonical SMILES: C1CCC(CC1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3
• InChI: ICVUZKQDJNUMKC-UHFFFAOYSA-N
• InChI Key: InChI=1S/C18H21OP/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-2,4-7,10-13,18H,3,8-9,14-15H2
• Boiling Point: 397.2±11.0 °C(Predicted)
• Melting Point: 168-172 °C(lit.)
• Density: 1.10±0.1 g/cm3(Predicted)
• Appearance: Solid
• Complexity: 311
• Covalently-Bonded Unit Count: 1
• EC Number: 237-204-6
• Exact Mass: 284.133g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 20
• Isomeric SMILES: C1CCC(CC1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3
• Monoisotopic Mass: 284.133g/mol
• Rotatable Bond Count: 3
• Topological Polar Surface Area: 17.1A^2

Custom Q&A

What is the CAS number for Diphenyl(cyclohexyl)phosphine oxide?

The CAS number for Diphenyl(cyclohexyl)phosphine oxide is 13689-20-8.

What is the Canonical SMILES representation of Diphenyl(cyclohexyl)phosphine oxide?

The Canonical SMILES representation of Diphenyl(cyclohexyl)phosphine oxide is C1CCC(CC1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3.

How many heavy atoms are present in Diphenyl(cyclohexyl)phosphine oxide?

There are 20 heavy atoms present in Diphenyl(cyclohexyl)phosphine oxide.

What is the XLogP3 value of Diphenyl(cyclohexyl)phosphine oxide?

The XLogP3 value of Diphenyl(cyclohexyl)phosphine oxide is 4.3.

What is the molecular formula of Diphenyl(cyclohexyl)phosphine oxide?

The molecular formula of Diphenyl(cyclohexyl)phosphine oxide is C18H21OP.

What is the IUPAC Name of Diphenyl(cyclohexyl)phosphine oxide?

The IUPAC Name of Diphenyl(cyclohexyl)phosphine oxide is [cyclohexyl(phenyl)phosphonoyl]benzene.

What is the InChI representation of Diphenyl(cyclohexyl)phosphine oxide?

The InChI representation of Diphenyl(cyclohexyl)phosphine oxide is InChI=1S/C18H21OP/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-2,4-7,10-13,18H,3,8-9,14-15H2.

How many rotatable bonds are present in Diphenyl(cyclohexyl)phosphine oxide?

There are 3 rotatable bonds present in Diphenyl(cyclohexyl)phosphine oxide.

What is the exact mass of Diphenyl(cyclohexyl)phosphine oxide?

The exact mass of Diphenyl(cyclohexyl)phosphine oxide is 284.133002287.

What is the molecular weight of Diphenyl(cyclohexyl)phosphine oxide?

The molecular weight of Diphenyl(cyclohexyl)phosphine oxide is 284.3g/mol.