tert-butyl(dicyclopentyl)phosphane;palladium

C14H27PPd — CID 87489753

IUPACtert-butyl(dicyclopentyl)phosphane;palladium
SMILESCC(C)(C)P(C1CCCC1)C1CCCC1.[Pd]
InChIInChI=1S/C14H27P.Pd/c1-14(2,3)15(12-8-4-5-9-12)13-10-6-7-11-13;/h12-13H,4-11H2,1-3H3;
InChIKeyKJAMUEDGWZQEJP-UHFFFAOYSA-N
MW332.76 g/mol
LogP5.15
Rot. Bonds2

About tert-butyl(dicyclopentyl)phosphane;palladium

tert-butyl(dicyclopentyl)phosphane;palladium (PubChem CID 87489753) has the molecular formula C14H27PPd and a molecular weight of 332.76 g/mol. Its IUPAC name is tert-butyl(dicyclopentyl)phosphane;palladium.

Molecular Properties

Compound Nametert-butyl(dicyclopentyl)phosphane;palladium
PubChem CID87489753
Molecular FormulaC14H27PPd
Molecular Weight332.76 g/mol
Exact Mass332.09
IUPAC Nametert-butyl(dicyclopentyl)phosphane;palladium
SMILESCC(C)(C)P(C1CCCC1)C1CCCC1.[Pd]
InChIInChI=1S/C14H27P.Pd/c1-14(2,3)15(12-8-4-5-9-12)13-10-6-7-11-13;/h12-13H,4-11H2,1-3H3;
InChIKeyKJAMUEDGWZQEJP-UHFFFAOYSA-N
XLogP5.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.76
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dicyclohexyl(2-dicyclohexylphosphanylpropan-2-yl)phosphane;hydron;ditetrafluoroborate
CID 159706094
palladium;tricyclopentylphosphane
CID 87488912
tert-butyl-[2-[cyclohexyl(methyl)phosphanyl]ethyl]-methylphosphane
CID 177409079
tri(cyclooctyl)phosphane
CID 12970661
tri(cyclododecyl)phosphane
CID 19065577
chloroplatinum(1+);dicyclohexyl(2-dicyclohexylphosphanylethyl)phosphane;2-methanidyl-2-methylpropane
CID 15830283
N-(dicyclohexylphosphanylmethyl)-N,2-dimethylpropan-2-amine
CID 134396516
(4-tert-butylphenyl)-dicyclopentylphosphane
CID 118057418
ditert-butyl-(2-methylcyclohexyl)phosphane
CID 59751517
ditert-butyl(cyclopentyl)phosphane;1,3-dimethyl-5-[2,3,4,5-tetrakis(3,5-dimethylphenyl)cyclopentyl]benzene;iron
CID 86583277
gold(1+);tricyclohexylphosphane
CID 161082953
CID 11297590
CID 11297590

Frequently Asked Questions

What is the IUPAC name of tert-butyl(dicyclopentyl)phosphane;palladium?
The IUPAC name of tert-butyl(dicyclopentyl)phosphane;palladium (CID 87489753) is tert-butyl(dicyclopentyl)phosphane;palladium.
What is the SMILES notation for tert-butyl(dicyclopentyl)phosphane;palladium?
The canonical SMILES for tert-butyl(dicyclopentyl)phosphane;palladium is CC(C)(C)P(C1CCCC1)C1CCCC1.[Pd].
What is the InChIKey of tert-butyl(dicyclopentyl)phosphane;palladium?
The InChIKey is KJAMUEDGWZQEJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27P.Pd/c1-14(2,3)15(12-8-4-5-9-12)13-10-6-7-11-13;/h12-13H,4-11H2,1-3H3;.
What are the key properties of tert-butyl(dicyclopentyl)phosphane;palladium?
tert-butyl(dicyclopentyl)phosphane;palladium has a molecular weight of 332.76 g/mol, XLogP of 5.15, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(dicyclopentyl)phosphane;palladium is sourced from PubChem (CID 87489753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).