[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane

C13H27P — CID 170104157

IUPAC[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane
SMILESCC(C)(P)CCCC1CCCC1(C)C
InChIInChI=1S/C13H27P/c1-12(2)9-5-7-11(12)8-6-10-13(3,4)14/h11H,5-10,14H2,1-4H3
InChIKeyJZYXASXAILTAEG-UHFFFAOYSA-N
MW214.33 g/mol
LogP4.64
Rot. Bonds4

About [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane

[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane (PubChem CID 170104157) has the molecular formula C13H27P and a molecular weight of 214.33 g/mol. Its IUPAC name is [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane.

Molecular Properties

Compound Name[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane
PubChem CID170104157
Molecular FormulaC13H27P
Molecular Weight214.33 g/mol
Exact Mass214.19
IUPAC Name[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane
SMILESCC(C)(P)CCCC1CCCC1(C)C
InChIInChI=1S/C13H27P/c1-12(2)9-5-7-11(12)8-6-10-13(3,4)14/h11H,5-10,14H2,1-4H3
InChIKeyJZYXASXAILTAEG-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 54.64
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 [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane?
The IUPAC name of [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane (CID 170104157) is [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane.
What is the SMILES notation for [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane?
The canonical SMILES for [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane is CC(C)(P)CCCC1CCCC1(C)C.
What is the InChIKey of [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane?
The InChIKey is JZYXASXAILTAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27P/c1-12(2)9-5-7-11(12)8-6-10-13(3,4)14/h11H,5-10,14H2,1-4H3.
What are the key properties of [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane?
[5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane has a molecular weight of 214.33 g/mol, XLogP of 4.64, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,2-dimethylcyclopentyl)-2-methylpentan-2-yl]phosphane is sourced from PubChem (CID 170104157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).