cycloundecyl(methyl)phosphane

C12H25P — CID 69425221

IUPACcycloundecyl(methyl)phosphane
SMILESCPC1CCCCCCCCCC1
InChIInChI=1S/C12H25P/c1-13-12-10-8-6-4-2-3-5-7-9-11-12/h12-13H,2-11H2,1H3
InChIKeyLUHXJIXXJHBZMB-UHFFFAOYSA-N
MW200.31 g/mol
LogP4.58
Rot. Bonds1

About cycloundecyl(methyl)phosphane

cycloundecyl(methyl)phosphane (PubChem CID 69425221) has the molecular formula C12H25P and a molecular weight of 200.31 g/mol. Its IUPAC name is cycloundecyl(methyl)phosphane.

Molecular Properties

Compound Namecycloundecyl(methyl)phosphane
PubChem CID69425221
Molecular FormulaC12H25P
Molecular Weight200.31 g/mol
Exact Mass200.17
IUPAC Namecycloundecyl(methyl)phosphane
SMILESCPC1CCCCCCCCCC1
InChIInChI=1S/C12H25P/c1-13-12-10-8-6-4-2-3-5-7-9-11-12/h12-13H,2-11H2,1H3
InChIKeyLUHXJIXXJHBZMB-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 54.58
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 cycloundecyl(methyl)phosphane?
The IUPAC name of cycloundecyl(methyl)phosphane (CID 69425221) is cycloundecyl(methyl)phosphane.
What is the SMILES notation for cycloundecyl(methyl)phosphane?
The canonical SMILES for cycloundecyl(methyl)phosphane is CPC1CCCCCCCCCC1.
What is the InChIKey of cycloundecyl(methyl)phosphane?
The InChIKey is LUHXJIXXJHBZMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25P/c1-13-12-10-8-6-4-2-3-5-7-9-11-12/h12-13H,2-11H2,1H3.
What are the key properties of cycloundecyl(methyl)phosphane?
cycloundecyl(methyl)phosphane has a molecular weight of 200.31 g/mol, XLogP of 4.58, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cycloundecyl(methyl)phosphane is sourced from PubChem (CID 69425221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).