cyclododecyl(cyclopropyl)phosphane

C15H29P — CID 69425218

IUPACcyclododecyl(cyclopropyl)phosphane
SMILESC1CCCCCC(PC2CC2)CCCCC1
InChIInChI=1S/C15H29P/c1-2-4-6-8-10-14(16-15-12-13-15)11-9-7-5-3-1/h14-16H,1-13H2
InChIKeySPVAHXUEYDTAPY-UHFFFAOYSA-N
MW240.37 g/mol
LogP5.50
Rot. Bonds2

About cyclododecyl(cyclopropyl)phosphane

cyclododecyl(cyclopropyl)phosphane (PubChem CID 69425218) has the molecular formula C15H29P and a molecular weight of 240.37 g/mol. Its IUPAC name is cyclododecyl(cyclopropyl)phosphane.

Molecular Properties

Compound Namecyclododecyl(cyclopropyl)phosphane
PubChem CID69425218
Molecular FormulaC15H29P
Molecular Weight240.37 g/mol
Exact Mass240.20
IUPAC Namecyclododecyl(cyclopropyl)phosphane
SMILESC1CCCCCC(PC2CC2)CCCCC1
InChIInChI=1S/C15H29P/c1-2-4-6-8-10-14(16-15-12-13-15)11-9-7-5-3-1/h14-16H,1-13H2
InChIKeySPVAHXUEYDTAPY-UHFFFAOYSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.37
LogP ≤ 55.50
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 cyclododecyl(cyclopropyl)phosphane?
The IUPAC name of cyclododecyl(cyclopropyl)phosphane (CID 69425218) is cyclododecyl(cyclopropyl)phosphane.
What is the SMILES notation for cyclododecyl(cyclopropyl)phosphane?
The canonical SMILES for cyclododecyl(cyclopropyl)phosphane is C1CCCCCC(PC2CC2)CCCCC1.
What is the InChIKey of cyclododecyl(cyclopropyl)phosphane?
The InChIKey is SPVAHXUEYDTAPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29P/c1-2-4-6-8-10-14(16-15-12-13-15)11-9-7-5-3-1/h14-16H,1-13H2.
What are the key properties of cyclododecyl(cyclopropyl)phosphane?
cyclododecyl(cyclopropyl)phosphane has a molecular weight of 240.37 g/mol, XLogP of 5.50, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclododecyl(cyclopropyl)phosphane is sourced from PubChem (CID 69425218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).