docosyl(docosylphosphanyl)phosphane

C44H92P2 — CID 21095052

IUPACdocosyl(docosylphosphanyl)phosphane
SMILESCCCCCCCCCCCCCCCCCCCCCCPPCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C44H92P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h45-46H,3-44H2,1-2H3
InChIKeyQQCFFWGEMAKLMM-UHFFFAOYSA-N
MW683.17 g/mol
LogP17.90
Rot. Bonds43

About docosyl(docosylphosphanyl)phosphane

docosyl(docosylphosphanyl)phosphane (PubChem CID 21095052) has the molecular formula C44H92P2 and a molecular weight of 683.17 g/mol. Its IUPAC name is docosyl(docosylphosphanyl)phosphane.

Molecular Properties

Compound Namedocosyl(docosylphosphanyl)phosphane
PubChem CID21095052
Molecular FormulaC44H92P2
Molecular Weight683.17 g/mol
Exact Mass682.67
IUPAC Namedocosyl(docosylphosphanyl)phosphane
SMILESCCCCCCCCCCCCCCCCCCCCCCPPCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C44H92P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h45-46H,3-44H2,1-2H3
InChIKeyQQCFFWGEMAKLMM-UHFFFAOYSA-N
XLogP17.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds43
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500683.17
LogP ≤ 517.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

octyl(pentylphosphanyl)phosphane
CID 21095189
heptyl(methylphosphanyl)phosphane
CID 21095173
decyl(undecyl)phosphane
CID 87830755
di(nonadecyl)phosphane
CID 87828565
dodecyl(octyl)phosphane
CID 87829037
methyl(tetradecyl)phosphane
CID 88708624
di(nonyl)phosphane;hydrochloride
CID 175813490
butyl(heptadecyl)phosphane
CID 146521828
CID 161246447
CID 161246447
decane;heptane
CID 159049036
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782

Frequently Asked Questions

What is the IUPAC name of docosyl(docosylphosphanyl)phosphane?
The IUPAC name of docosyl(docosylphosphanyl)phosphane (CID 21095052) is docosyl(docosylphosphanyl)phosphane.
What is the SMILES notation for docosyl(docosylphosphanyl)phosphane?
The canonical SMILES for docosyl(docosylphosphanyl)phosphane is CCCCCCCCCCCCCCCCCCCCCCPPCCCCCCCCCCCCCCCCCCCCCC.
What is the InChIKey of docosyl(docosylphosphanyl)phosphane?
The InChIKey is QQCFFWGEMAKLMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H92P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h45-46H,3-44H2,1-2H3.
What are the key properties of docosyl(docosylphosphanyl)phosphane?
docosyl(docosylphosphanyl)phosphane has a molecular weight of 683.17 g/mol, XLogP of 17.90, 43 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for docosyl(docosylphosphanyl)phosphane is sourced from PubChem (CID 21095052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).