3-diethoxyphosphorylpropyl(diphenyl)phosphane

C19H26O3P2 — CID 54349013

IUPAC3-diethoxyphosphorylpropyl(diphenyl)phosphane
SMILESCCOP(=O)(CCCP(c1ccccc1)c1ccccc1)OCC
InChIInChI=1S/C19H26O3P2/c1-3-21-24(20,22-4-2)17-11-16-23(18-12-7-5-8-13-18)19-14-9-6-10-15-19/h5-10,12-15H,3-4,11,16-17H2,1-2H3
InChIKeyUEJGXXCLMOLMCJ-UHFFFAOYSA-N
MW364.36 g/mol
LogP4.78
Rot. Bonds10

About 3-diethoxyphosphorylpropyl(diphenyl)phosphane

3-diethoxyphosphorylpropyl(diphenyl)phosphane (PubChem CID 54349013) has the molecular formula C19H26O3P2 and a molecular weight of 364.36 g/mol. Its IUPAC name is 3-diethoxyphosphorylpropyl(diphenyl)phosphane.

Molecular Properties

Compound Name3-diethoxyphosphorylpropyl(diphenyl)phosphane
PubChem CID54349013
Molecular FormulaC19H26O3P2
Molecular Weight364.36 g/mol
Exact Mass364.14
IUPAC Name3-diethoxyphosphorylpropyl(diphenyl)phosphane
SMILESCCOP(=O)(CCCP(c1ccccc1)c1ccccc1)OCC
InChIInChI=1S/C19H26O3P2/c1-3-21-24(20,22-4-2)17-11-16-23(18-12-7-5-8-13-18)19-14-9-6-10-15-19/h5-10,12-15H,3-4,11,16-17H2,1-2H3
InChIKeyUEJGXXCLMOLMCJ-UHFFFAOYSA-N
XLogP4.78
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.36
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-diethoxyphosphorylpropyl(diphenyl)phosphane?
The IUPAC name of 3-diethoxyphosphorylpropyl(diphenyl)phosphane (CID 54349013) is 3-diethoxyphosphorylpropyl(diphenyl)phosphane.
What is the SMILES notation for 3-diethoxyphosphorylpropyl(diphenyl)phosphane?
The canonical SMILES for 3-diethoxyphosphorylpropyl(diphenyl)phosphane is CCOP(=O)(CCCP(c1ccccc1)c1ccccc1)OCC.
What is the InChIKey of 3-diethoxyphosphorylpropyl(diphenyl)phosphane?
The InChIKey is UEJGXXCLMOLMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26O3P2/c1-3-21-24(20,22-4-2)17-11-16-23(18-12-7-5-8-13-18)19-14-9-6-10-15-19/h5-10,12-15H,3-4,11,16-17H2,1-2H3.
What are the key properties of 3-diethoxyphosphorylpropyl(diphenyl)phosphane?
3-diethoxyphosphorylpropyl(diphenyl)phosphane has a molecular weight of 364.36 g/mol, XLogP of 4.78, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-diethoxyphosphorylpropyl(diphenyl)phosphane is sourced from PubChem (CID 54349013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).