cyclononyl(ethyl)phosphane

C11H23P — CID 69425111

IUPACcyclononyl(ethyl)phosphane
SMILESCCPC1CCCCCCCC1
InChIInChI=1S/C11H23P/c1-2-12-11-9-7-5-3-4-6-8-10-11/h11-12H,2-10H2,1H3
InChIKeyALGCQGNGCMOWTA-UHFFFAOYSA-N
MW186.28 g/mol
LogP4.19
Rot. Bonds2

About cyclononyl(ethyl)phosphane

cyclononyl(ethyl)phosphane (PubChem CID 69425111) has the molecular formula C11H23P and a molecular weight of 186.28 g/mol. Its IUPAC name is cyclononyl(ethyl)phosphane.

Molecular Properties

Compound Namecyclononyl(ethyl)phosphane
PubChem CID69425111
Molecular FormulaC11H23P
Molecular Weight186.28 g/mol
Exact Mass186.15
IUPAC Namecyclononyl(ethyl)phosphane
SMILESCCPC1CCCCCCCC1
InChIInChI=1S/C11H23P/c1-2-12-11-9-7-5-3-4-6-8-10-11/h11-12H,2-10H2,1H3
InChIKeyALGCQGNGCMOWTA-UHFFFAOYSA-N
XLogP4.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 54.19
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 cyclononyl(ethyl)phosphane?
The IUPAC name of cyclononyl(ethyl)phosphane (CID 69425111) is cyclononyl(ethyl)phosphane.
What is the SMILES notation for cyclononyl(ethyl)phosphane?
The canonical SMILES for cyclononyl(ethyl)phosphane is CCPC1CCCCCCCC1.
What is the InChIKey of cyclononyl(ethyl)phosphane?
The InChIKey is ALGCQGNGCMOWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23P/c1-2-12-11-9-7-5-3-4-6-8-10-11/h11-12H,2-10H2,1H3.
What are the key properties of cyclononyl(ethyl)phosphane?
cyclononyl(ethyl)phosphane has a molecular weight of 186.28 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclononyl(ethyl)phosphane is sourced from PubChem (CID 69425111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).