bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane

C25H58P6 — CID 6392753

IUPACbis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane
SMILESCCP(CC)CCP(CCP(CC)CC)CP(CCP(CC)CC)CCP(CC)CC
InChIInChI=1S/C25H58P6/c1-9-26(10-2)17-21-30(22-18-27(11-3)12-4)25-31(23-19-28(13-5)14-6)24-20-29(15-7)16-8/h9-25H2,1-8H3
InChIKeyNRRDTOPZUAMMPL-UHFFFAOYSA-N
MW544.58 g/mol
LogP9.99
Rot. Bonds22

About bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane

bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane (PubChem CID 6392753) has the molecular formula C25H58P6 and a molecular weight of 544.58 g/mol. Its IUPAC name is bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane.

Molecular Properties

Compound Namebis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane
PubChem CID6392753
Molecular FormulaC25H58P6
Molecular Weight544.58 g/mol
Exact Mass544.30
IUPAC Namebis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane
SMILESCCP(CC)CCP(CCP(CC)CC)CP(CCP(CC)CC)CCP(CC)CC
InChIInChI=1S/C25H58P6/c1-9-26(10-2)17-21-30(22-18-27(11-3)12-4)25-31(23-19-28(13-5)14-6)24-20-29(15-7)16-8/h9-25H2,1-8H3
InChIKeyNRRDTOPZUAMMPL-UHFFFAOYSA-N
XLogP9.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds22
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500544.58
LogP ≤ 59.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane?
The IUPAC name of bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane (CID 6392753) is bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane.
What is the SMILES notation for bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane?
The canonical SMILES for bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane is CCP(CC)CCP(CCP(CC)CC)CP(CCP(CC)CC)CCP(CC)CC.
What is the InChIKey of bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane?
The InChIKey is NRRDTOPZUAMMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H58P6/c1-9-26(10-2)17-21-30(22-18-27(11-3)12-4)25-31(23-19-28(13-5)14-6)24-20-29(15-7)16-8/h9-25H2,1-8H3.
What are the key properties of bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane?
bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane has a molecular weight of 544.58 g/mol, XLogP of 9.99, 22 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-diethylphosphanylethyl)phosphanylmethyl-bis(2-diethylphosphanylethyl)phosphane is sourced from PubChem (CID 6392753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).