nickel;tricyclopentylphosphane

C15H27NiP — CID 175468983

IUPACnickel;tricyclopentylphosphane
SMILESC1CCC(P(C2CCCC2)C2CCCC2)C1.[Ni]
InChIInChI=1S/C15H27P.Ni/c1-2-8-13(7-1)16(14-9-3-4-10-14)15-11-5-6-12-15;/h13-15H,1-12H2;
InChIKeyFWYSVDYCGPTEJC-UHFFFAOYSA-N
MW297.05 g/mol
LogP5.29
Rot. Bonds3

About nickel;tricyclopentylphosphane

nickel;tricyclopentylphosphane (PubChem CID 175468983) has the molecular formula C15H27NiP and a molecular weight of 297.05 g/mol. Its IUPAC name is nickel;tricyclopentylphosphane.

Molecular Properties

Compound Namenickel;tricyclopentylphosphane
PubChem CID175468983
Molecular FormulaC15H27NiP
Molecular Weight297.05 g/mol
Exact Mass296.12
IUPAC Namenickel;tricyclopentylphosphane
SMILESC1CCC(P(C2CCCC2)C2CCCC2)C1.[Ni]
InChIInChI=1S/C15H27P.Ni/c1-2-8-13(7-1)16(14-9-3-4-10-14)15-11-5-6-12-15;/h13-15H,1-12H2;
InChIKeyFWYSVDYCGPTEJC-UHFFFAOYSA-N
XLogP5.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.05
LogP ≤ 55.29
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 nickel;tricyclopentylphosphane?
The IUPAC name of nickel;tricyclopentylphosphane (CID 175468983) is nickel;tricyclopentylphosphane.
What is the SMILES notation for nickel;tricyclopentylphosphane?
The canonical SMILES for nickel;tricyclopentylphosphane is C1CCC(P(C2CCCC2)C2CCCC2)C1.[Ni].
What is the InChIKey of nickel;tricyclopentylphosphane?
The InChIKey is FWYSVDYCGPTEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27P.Ni/c1-2-8-13(7-1)16(14-9-3-4-10-14)15-11-5-6-12-15;/h13-15H,1-12H2;.
What are the key properties of nickel;tricyclopentylphosphane?
nickel;tricyclopentylphosphane has a molecular weight of 297.05 g/mol, XLogP of 5.29, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;tricyclopentylphosphane is sourced from PubChem (CID 175468983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).