2-diphenylphosphanyloxyethoxy(diphenyl)phosphane

C26H24O2P2 — CID 10950051

IUPAC2-diphenylphosphanyloxyethoxy(diphenyl)phosphane
SMILESc1ccc(P(OCCOP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24O2P2/c1-5-13-23(14-6-1)29(24-15-7-2-8-16-24)27-21-22-28-30(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
InChIKeyYMGWZUDZLDWQSC-UHFFFAOYSA-N
MW430.42 g/mol
LogP5.12
Rot. Bonds9

About 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane

2-diphenylphosphanyloxyethoxy(diphenyl)phosphane (PubChem CID 10950051) has the molecular formula C26H24O2P2 and a molecular weight of 430.42 g/mol. Its IUPAC name is 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane.

Molecular Properties

Compound Name2-diphenylphosphanyloxyethoxy(diphenyl)phosphane
PubChem CID10950051
Molecular FormulaC26H24O2P2
Molecular Weight430.42 g/mol
Exact Mass430.13
IUPAC Name2-diphenylphosphanyloxyethoxy(diphenyl)phosphane
SMILESc1ccc(P(OCCOP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24O2P2/c1-5-13-23(14-6-1)29(24-15-7-2-8-16-24)27-21-22-28-30(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
InChIKeyYMGWZUDZLDWQSC-UHFFFAOYSA-N
XLogP5.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.42
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-diphenylphosphanyloxyethoxy(diphenyl)phosphane?
The IUPAC name of 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane (CID 10950051) is 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane.
What is the SMILES notation for 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane?
The canonical SMILES for 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane is c1ccc(P(OCCOP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane?
The InChIKey is YMGWZUDZLDWQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24O2P2/c1-5-13-23(14-6-1)29(24-15-7-2-8-16-24)27-21-22-28-30(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2.
What are the key properties of 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane?
2-diphenylphosphanyloxyethoxy(diphenyl)phosphane has a molecular weight of 430.42 g/mol, XLogP of 5.12, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyloxyethoxy(diphenyl)phosphane is sourced from PubChem (CID 10950051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).