1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane

C33H36P2 — CID 23403232

IUPAC1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane
SMILESCC(C1CCCC1C(C)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C33H36P2/c1-26(34(28-16-7-3-8-17-28)29-18-9-4-10-19-29)32-24-15-25-33(32)27(2)35(30-20-11-5-12-21-30)31-22-13-6-14-23-31/h3-14,16-23,26-27,32-33H,15,24-25H2,1-2H3
InChIKeyHSEOYVVBCHGZHZ-UHFFFAOYSA-N
MW494.60 g/mol
LogP7.45
Rot. Bonds8

About 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane

1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane (PubChem CID 23403232) has the molecular formula C33H36P2 and a molecular weight of 494.60 g/mol. Its IUPAC name is 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane.

Molecular Properties

Compound Name1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane
PubChem CID23403232
Molecular FormulaC33H36P2
Molecular Weight494.60 g/mol
Exact Mass494.23
IUPAC Name1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane
SMILESCC(C1CCCC1C(C)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C33H36P2/c1-26(34(28-16-7-3-8-17-28)29-18-9-4-10-19-29)32-24-15-25-33(32)27(2)35(30-20-11-5-12-21-30)31-22-13-6-14-23-31/h3-14,16-23,26-27,32-33H,15,24-25H2,1-2H3
InChIKeyHSEOYVVBCHGZHZ-UHFFFAOYSA-N
XLogP7.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.60
LogP ≤ 57.45
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

[(1S)-1-[(1R,2R)-2-diphenylphosphanylcyclopentyl]ethyl]-diphenylphosphane
CID 141093024
cyclopentane;dicyclohexyl-[2-(1-diphenylphosphanylethyl)cyclopentyl]phosphane;iron
CID 155887361
[(1S)-1-(2-tert-butylphosphonoylcyclopentyl)ethyl]-diphenylphosphane
CID 155884992
[(1S)-1-[(1S,2S)-2-diphenylphosphanylcyclopentyl]-2-methylpropyl]-diphenylphosphane
CID 11698892
1-[3-(1-diphenylphosphanylethyl)-1,4-diazabicyclo[2.2.2]octan-2-yl]ethyl-diphenylphosphane
CID 23403259
(1R)-1-[(1S,2S)-2-diphenylphosphanylcyclopentyl]ethanamine
CID 90131117
cyclopentane;diphenyl-(2-propan-2-ylcyclopentyl)phosphane
CID 90737985
bis[(1S)-1-cyclopentylethyl]-phenylphosphane
CID 59045088
[(2R,3R)-3-diphenylphosphanylbutan-2-yl]-diphenylphosphane
CID 2724948
cyclopentane;ditert-butyl-[1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane;iron
CID 91663083
cyclopentane;ditert-butyl-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane;iron
CID 117061916
1-[10-(1-diphenylphosphanylethyl)-11-oxatricyclo[6.2.1.02,7]undeca-2,4,6-trien-9-yl]ethyl-diphenylphosphane
CID 23403298

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane?
The IUPAC name of 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane (CID 23403232) is 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane.
What is the SMILES notation for 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane?
The canonical SMILES for 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane is CC(C1CCCC1C(C)P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane?
The InChIKey is HSEOYVVBCHGZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H36P2/c1-26(34(28-16-7-3-8-17-28)29-18-9-4-10-19-29)32-24-15-25-33(32)27(2)35(30-20-11-5-12-21-30)31-22-13-6-14-23-31/h3-14,16-23,26-27,32-33H,15,24-25H2,1-2H3.
What are the key properties of 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane?
1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane has a molecular weight of 494.60 g/mol, XLogP of 7.45, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane is sourced from PubChem (CID 23403232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).