3-phosphanylundecan-3-ylphosphane

C11H26P2 — CID 174432995

IUPAC3-phosphanylundecan-3-ylphosphane
SMILESCCCCCCCCC(P)(P)CC
InChIInChI=1S/C11H26P2/c1-3-5-6-7-8-9-10-11(12,13)4-2/h3-10,12-13H2,1-2H3
InChIKeyYBGJINYNCPWFEV-UHFFFAOYSA-N
MW220.28 g/mol
LogP4.59
Rot. Bonds8

About 3-phosphanylundecan-3-ylphosphane

3-phosphanylundecan-3-ylphosphane (PubChem CID 174432995) has the molecular formula C11H26P2 and a molecular weight of 220.28 g/mol. Its IUPAC name is 3-phosphanylundecan-3-ylphosphane.

Molecular Properties

Compound Name3-phosphanylundecan-3-ylphosphane
PubChem CID174432995
Molecular FormulaC11H26P2
Molecular Weight220.28 g/mol
Exact Mass220.15
IUPAC Name3-phosphanylundecan-3-ylphosphane
SMILESCCCCCCCCC(P)(P)CC
InChIInChI=1S/C11H26P2/c1-3-5-6-7-8-9-10-11(12,13)4-2/h3-10,12-13H2,1-2H3
InChIKeyYBGJINYNCPWFEV-UHFFFAOYSA-N
XLogP4.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 3-phosphanylundecan-3-ylphosphane?
The IUPAC name of 3-phosphanylundecan-3-ylphosphane (CID 174432995) is 3-phosphanylundecan-3-ylphosphane.
What is the SMILES notation for 3-phosphanylundecan-3-ylphosphane?
The canonical SMILES for 3-phosphanylundecan-3-ylphosphane is CCCCCCCCC(P)(P)CC.
What is the InChIKey of 3-phosphanylundecan-3-ylphosphane?
The InChIKey is YBGJINYNCPWFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26P2/c1-3-5-6-7-8-9-10-11(12,13)4-2/h3-10,12-13H2,1-2H3.
What are the key properties of 3-phosphanylundecan-3-ylphosphane?
3-phosphanylundecan-3-ylphosphane has a molecular weight of 220.28 g/mol, XLogP of 4.59, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phosphanylundecan-3-ylphosphane is sourced from PubChem (CID 174432995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).