2-phenoxyphosphanylethyl(diphenyl)phosphane

C20H20OP2 — CID 54309346

IUPAC2-phenoxyphosphanylethyl(diphenyl)phosphane
SMILESc1ccc(OPCCP(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H20OP2/c1-4-10-18(11-5-1)21-22-16-17-23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,22H,16-17H2
InChIKeySJUFOSSTFGHMET-UHFFFAOYSA-N
MW338.33 g/mol
LogP4.79
Rot. Bonds7

About 2-phenoxyphosphanylethyl(diphenyl)phosphane

2-phenoxyphosphanylethyl(diphenyl)phosphane (PubChem CID 54309346) has the molecular formula C20H20OP2 and a molecular weight of 338.33 g/mol. Its IUPAC name is 2-phenoxyphosphanylethyl(diphenyl)phosphane.

Molecular Properties

Compound Name2-phenoxyphosphanylethyl(diphenyl)phosphane
PubChem CID54309346
Molecular FormulaC20H20OP2
Molecular Weight338.33 g/mol
Exact Mass338.10
IUPAC Name2-phenoxyphosphanylethyl(diphenyl)phosphane
SMILESc1ccc(OPCCP(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H20OP2/c1-4-10-18(11-5-1)21-22-16-17-23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,22H,16-17H2
InChIKeySJUFOSSTFGHMET-UHFFFAOYSA-N
XLogP4.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.33
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxyphosphanylethyl(diphenyl)phosphane?
The IUPAC name of 2-phenoxyphosphanylethyl(diphenyl)phosphane (CID 54309346) is 2-phenoxyphosphanylethyl(diphenyl)phosphane.
What is the SMILES notation for 2-phenoxyphosphanylethyl(diphenyl)phosphane?
The canonical SMILES for 2-phenoxyphosphanylethyl(diphenyl)phosphane is c1ccc(OPCCP(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-phenoxyphosphanylethyl(diphenyl)phosphane?
The InChIKey is SJUFOSSTFGHMET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20OP2/c1-4-10-18(11-5-1)21-22-16-17-23(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,22H,16-17H2.
What are the key properties of 2-phenoxyphosphanylethyl(diphenyl)phosphane?
2-phenoxyphosphanylethyl(diphenyl)phosphane has a molecular weight of 338.33 g/mol, XLogP of 4.79, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxyphosphanylethyl(diphenyl)phosphane is sourced from PubChem (CID 54309346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).