[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane

C7H22P6 — CID 164810270

IUPAC[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane
SMILESCC(P)(P)CC(P)(P)CC(C)(P)P
InChIInChI=1S/C7H22P6/c1-5(8,9)3-7(12,13)4-6(2,10)11/h3-4,8-13H2,1-2H3
InChIKeyAJYJTMUOFCUVTR-UHFFFAOYSA-N
MW292.10 g/mol
LogP3.15
Rot. Bonds4

About [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane

[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane (PubChem CID 164810270) has the molecular formula C7H22P6 and a molecular weight of 292.10 g/mol. Its IUPAC name is [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane.

Molecular Properties

Compound Name[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane
PubChem CID164810270
Molecular FormulaC7H22P6
Molecular Weight292.10 g/mol
Exact Mass292.01
IUPAC Name[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane
SMILESCC(P)(P)CC(P)(P)CC(C)(P)P
InChIInChI=1S/C7H22P6/c1-5(8,9)3-7(12,13)4-6(2,10)11/h3-4,8-13H2,1-2H3
InChIKeyAJYJTMUOFCUVTR-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.10
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]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 [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane?
The IUPAC name of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane (CID 164810270) is [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane.
What is the SMILES notation for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane?
The canonical SMILES for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane is CC(P)(P)CC(P)(P)CC(C)(P)P.
What is the InChIKey of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane?
The InChIKey is AJYJTMUOFCUVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H22P6/c1-5(8,9)3-7(12,13)4-6(2,10)11/h3-4,8-13H2,1-2H3.
What are the key properties of [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane?
[1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane has a molecular weight of 292.10 g/mol, XLogP of 3.15, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2,2-bis(phosphanyl)propyl]-1,3,3-tris(phosphanyl)butyl]phosphane is sourced from PubChem (CID 164810270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).