4-phosphanylbutylphosphane

C4H12P2 — CID 10986207

IUPAC4-phosphanylbutylphosphane
SMILESPCCCCP
InChIInChI=1S/C4H12P2/c5-3-1-2-4-6/h1-6H2
InChIKeyVOAXSDYMVCZQHO-UHFFFAOYSA-N
MW122.09 g/mol
LogP1.52
Rot. Bonds3

About 4-phosphanylbutylphosphane

4-phosphanylbutylphosphane (PubChem CID 10986207) has the molecular formula C4H12P2 and a molecular weight of 122.09 g/mol. Its IUPAC name is 4-phosphanylbutylphosphane.

Molecular Properties

Compound Name4-phosphanylbutylphosphane
PubChem CID10986207
Molecular FormulaC4H12P2
Molecular Weight122.09 g/mol
Exact Mass122.04
IUPAC Name4-phosphanylbutylphosphane
SMILESPCCCCP
InChIInChI=1S/C4H12P2/c5-3-1-2-4-6/h1-6H2
InChIKeyVOAXSDYMVCZQHO-UHFFFAOYSA-N
XLogP1.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.09
LogP ≤ 51.52
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 4-phosphanylbutylphosphane?
The IUPAC name of 4-phosphanylbutylphosphane (CID 10986207) is 4-phosphanylbutylphosphane.
What is the SMILES notation for 4-phosphanylbutylphosphane?
The canonical SMILES for 4-phosphanylbutylphosphane is PCCCCP.
What is the InChIKey of 4-phosphanylbutylphosphane?
The InChIKey is VOAXSDYMVCZQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12P2/c5-3-1-2-4-6/h1-6H2.
What are the key properties of 4-phosphanylbutylphosphane?
4-phosphanylbutylphosphane has a molecular weight of 122.09 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phosphanylbutylphosphane is sourced from PubChem (CID 10986207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).