2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane

C12H28O5P2 — CID 59288669

IUPAC2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane
SMILESCC(COP)OCC(C)OC(C)COC(C)COP
InChIInChI=1S/C12H28O5P2/c1-9(7-15-18)13-5-11(3)17-12(4)6-14-10(2)8-16-19/h9-12H,5-8,18-19H2,1-4H3
InChIKeyZXXRUJYWRLGNKO-UHFFFAOYSA-N
MW314.30 g/mol
LogP2.20
Rot. Bonds12

About 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane

2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane (PubChem CID 59288669) has the molecular formula C12H28O5P2 and a molecular weight of 314.30 g/mol. Its IUPAC name is 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane.

Molecular Properties

Compound Name2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane
PubChem CID59288669
Molecular FormulaC12H28O5P2
Molecular Weight314.30 g/mol
Exact Mass314.14
IUPAC Name2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane
SMILESCC(COP)OCC(C)OC(C)COC(C)COP
InChIInChI=1S/C12H28O5P2/c1-9(7-15-18)13-5-11(3)17-12(4)6-14-10(2)8-16-19/h9-12H,5-8,18-19H2,1-4H3
InChIKeyZXXRUJYWRLGNKO-UHFFFAOYSA-N
XLogP2.20
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.30
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane?
The IUPAC name of 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane (CID 59288669) is 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane.
What is the SMILES notation for 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane?
The canonical SMILES for 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane is CC(COP)OCC(C)OC(C)COC(C)COP.
What is the InChIKey of 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane?
The InChIKey is ZXXRUJYWRLGNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O5P2/c1-9(7-15-18)13-5-11(3)17-12(4)6-14-10(2)8-16-19/h9-12H,5-8,18-19H2,1-4H3.
What are the key properties of 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane?
2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane has a molecular weight of 314.30 g/mol, XLogP of 2.20, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propoxy]propoxyphosphane is sourced from PubChem (CID 59288669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).