palladium;tritert-butylphosphane

C12H27PPd — CID 71406666

IUPACpalladium;tritert-butylphosphane
SMILESCC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd]
InChIInChI=1S/C12H27P.Pd/c1-10(2,3)13(11(4,5)6)12(7,8)9;/h1-9H3;
InChIKeyLOJAQAYKWFMKMR-UHFFFAOYSA-N
MW308.74 g/mol
LogP4.86
Rot. Bonds

About palladium;tritert-butylphosphane

palladium;tritert-butylphosphane (PubChem CID 71406666) has the molecular formula C12H27PPd and a molecular weight of 308.74 g/mol. Its IUPAC name is palladium;tritert-butylphosphane.

Molecular Properties

Compound Namepalladium;tritert-butylphosphane
PubChem CID71406666
Molecular FormulaC12H27PPd
Molecular Weight308.74 g/mol
Exact Mass308.09
IUPAC Namepalladium;tritert-butylphosphane
SMILESCC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd]
InChIInChI=1S/C12H27P.Pd/c1-10(2,3)13(11(4,5)6)12(7,8)9;/h1-9H3;
InChIKeyLOJAQAYKWFMKMR-UHFFFAOYSA-N
XLogP4.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.74
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of palladium;tritert-butylphosphane?
The IUPAC name of palladium;tritert-butylphosphane (CID 71406666) is palladium;tritert-butylphosphane.
What is the SMILES notation for palladium;tritert-butylphosphane?
The canonical SMILES for palladium;tritert-butylphosphane is CC(C)(C)P(C(C)(C)C)C(C)(C)C.[Pd].
What is the InChIKey of palladium;tritert-butylphosphane?
The InChIKey is LOJAQAYKWFMKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27P.Pd/c1-10(2,3)13(11(4,5)6)12(7,8)9;/h1-9H3;.
What are the key properties of palladium;tritert-butylphosphane?
palladium;tritert-butylphosphane has a molecular weight of 308.74 g/mol, XLogP of 4.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for palladium;tritert-butylphosphane is sourced from PubChem (CID 71406666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).