(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane

C35H31P — CID 141287167

IUPAC(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane
SMILESPC1(c2ccccc2)CCC(c2ccccc2)(c2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C35H31P/c36-34(30-20-10-3-11-21-30)27-26-33(28-16-6-1-7-17-28,29-18-8-2-9-19-29)35(34,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25H,26-27,36H2
InChIKeyAWWFXFCAQXZEIG-UHFFFAOYSA-N
MW482.61 g/mol
LogP8.52
Rot. Bonds5

About (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane

(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane (PubChem CID 141287167) has the molecular formula C35H31P and a molecular weight of 482.61 g/mol. Its IUPAC name is (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane.

Molecular Properties

Compound Name(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane
PubChem CID141287167
Molecular FormulaC35H31P
Molecular Weight482.61 g/mol
Exact Mass482.22
IUPAC Name(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane
SMILESPC1(c2ccccc2)CCC(c2ccccc2)(c2ccccc2)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C35H31P/c36-34(30-20-10-3-11-21-30)27-26-33(28-16-6-1-7-17-28,29-18-8-2-9-19-29)35(34,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25H,26-27,36H2
InChIKeyAWWFXFCAQXZEIG-UHFFFAOYSA-N
XLogP8.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.61
LogP ≤ 58.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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6,6-diphenyloxan-2-one
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Frequently Asked Questions

What is the IUPAC name of (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane?
The IUPAC name of (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane (CID 141287167) is (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane.
What is the SMILES notation for (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane?
The canonical SMILES for (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane is PC1(c2ccccc2)CCC(c2ccccc2)(c2ccccc2)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane?
The InChIKey is AWWFXFCAQXZEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H31P/c36-34(30-20-10-3-11-21-30)27-26-33(28-16-6-1-7-17-28,29-18-8-2-9-19-29)35(34,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25H,26-27,36H2.
What are the key properties of (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane?
(1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane has a molecular weight of 482.61 g/mol, XLogP of 8.52, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,2,3,3-pentakis-phenylcyclopentyl)phosphane is sourced from PubChem (CID 141287167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).