(3-phosphanyloxyphenoxy)phosphane

C6H8O2P2 — CID 89228222

IUPAC(3-phosphanyloxyphenoxy)phosphane
SMILESPOc1cccc(OP)c1
InChIInChI=1S/C6H8O2P2/c9-7-5-2-1-3-6(4-5)8-10/h1-4H,9-10H2
InChIKeyUXMMINWCRFPQGL-UHFFFAOYSA-N
MW174.08 g/mol
LogP2.02
Rot. Bonds2

About (3-phosphanyloxyphenoxy)phosphane

(3-phosphanyloxyphenoxy)phosphane (PubChem CID 89228222) has the molecular formula C6H8O2P2 and a molecular weight of 174.08 g/mol. Its IUPAC name is (3-phosphanyloxyphenoxy)phosphane.

Molecular Properties

Compound Name(3-phosphanyloxyphenoxy)phosphane
PubChem CID89228222
Molecular FormulaC6H8O2P2
Molecular Weight174.08 g/mol
Exact Mass174.00
IUPAC Name(3-phosphanyloxyphenoxy)phosphane
SMILESPOc1cccc(OP)c1
InChIInChI=1S/C6H8O2P2/c9-7-5-2-1-3-6(4-5)8-10/h1-4H,9-10H2
InChIKeyUXMMINWCRFPQGL-UHFFFAOYSA-N
XLogP2.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.08
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (3-phosphanyloxyphenoxy)phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-phosphanyloxyphenoxy)phosphane?
The IUPAC name of (3-phosphanyloxyphenoxy)phosphane (CID 89228222) is (3-phosphanyloxyphenoxy)phosphane.
What is the SMILES notation for (3-phosphanyloxyphenoxy)phosphane?
The canonical SMILES for (3-phosphanyloxyphenoxy)phosphane is POc1cccc(OP)c1.
What is the InChIKey of (3-phosphanyloxyphenoxy)phosphane?
The InChIKey is UXMMINWCRFPQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2P2/c9-7-5-2-1-3-6(4-5)8-10/h1-4H,9-10H2.
What are the key properties of (3-phosphanyloxyphenoxy)phosphane?
(3-phosphanyloxyphenoxy)phosphane has a molecular weight of 174.08 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phosphanyloxyphenoxy)phosphane is sourced from PubChem (CID 89228222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).