4-cyclohexylphosphinine

C11H15P — CID 12696907

IUPAC4-cyclohexylphosphinine
SMILESc1cc(C2CCCCC2)ccp1
InChIInChI=1S/C11H15P/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-10H,1-5H2
InChIKeyXQVQUZIUBSXHLP-UHFFFAOYSA-N
MW178.22 g/mol
LogP4.31
Rot. Bonds1

About 4-cyclohexylphosphinine

4-cyclohexylphosphinine (PubChem CID 12696907) has the molecular formula C11H15P and a molecular weight of 178.22 g/mol. Its IUPAC name is 4-cyclohexylphosphinine.

Molecular Properties

Compound Name4-cyclohexylphosphinine
PubChem CID12696907
Molecular FormulaC11H15P
Molecular Weight178.22 g/mol
Exact Mass178.09
IUPAC Name4-cyclohexylphosphinine
SMILESc1cc(C2CCCCC2)ccp1
InChIInChI=1S/C11H15P/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-10H,1-5H2
InChIKeyXQVQUZIUBSXHLP-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.22
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexylphosphinine?
The IUPAC name of 4-cyclohexylphosphinine (CID 12696907) is 4-cyclohexylphosphinine.
What is the SMILES notation for 4-cyclohexylphosphinine?
The canonical SMILES for 4-cyclohexylphosphinine is c1cc(C2CCCCC2)ccp1.
What is the InChIKey of 4-cyclohexylphosphinine?
The InChIKey is XQVQUZIUBSXHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15P/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-10H,1-5H2.
What are the key properties of 4-cyclohexylphosphinine?
4-cyclohexylphosphinine has a molecular weight of 178.22 g/mol, XLogP of 4.31, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexylphosphinine is sourced from PubChem (CID 12696907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).