9-fluoro-9-phosphabicyclo[3.3.1]nonane

C8H14FP — CID 89001053

IUPAC9-fluoro-9-phosphabicyclo[3.3.1]nonane
SMILESFP1C2CCCC1CCC2
InChIInChI=1S/C8H14FP/c9-10-7-3-1-4-8(10)6-2-5-7/h7-8H,1-6H2
InChIKeyORDXOQGZAVXZIW-UHFFFAOYSA-N
MW160.17 g/mol
LogP3.46
Rot. Bonds

About 9-fluoro-9-phosphabicyclo[3.3.1]nonane

9-fluoro-9-phosphabicyclo[3.3.1]nonane (PubChem CID 89001053) has the molecular formula C8H14FP and a molecular weight of 160.17 g/mol. Its IUPAC name is 9-fluoro-9-phosphabicyclo[3.3.1]nonane.

Molecular Properties

Compound Name9-fluoro-9-phosphabicyclo[3.3.1]nonane
PubChem CID89001053
Molecular FormulaC8H14FP
Molecular Weight160.17 g/mol
Exact Mass160.08
IUPAC Name9-fluoro-9-phosphabicyclo[3.3.1]nonane
SMILESFP1C2CCCC1CCC2
InChIInChI=1S/C8H14FP/c9-10-7-3-1-4-8(10)6-2-5-7/h7-8H,1-6H2
InChIKeyORDXOQGZAVXZIW-UHFFFAOYSA-N
XLogP3.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 53.46
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 9-fluoro-9-phosphabicyclo[3.3.1]nonane?
The IUPAC name of 9-fluoro-9-phosphabicyclo[3.3.1]nonane (CID 89001053) is 9-fluoro-9-phosphabicyclo[3.3.1]nonane.
What is the SMILES notation for 9-fluoro-9-phosphabicyclo[3.3.1]nonane?
The canonical SMILES for 9-fluoro-9-phosphabicyclo[3.3.1]nonane is FP1C2CCCC1CCC2.
What is the InChIKey of 9-fluoro-9-phosphabicyclo[3.3.1]nonane?
The InChIKey is ORDXOQGZAVXZIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FP/c9-10-7-3-1-4-8(10)6-2-5-7/h7-8H,1-6H2.
What are the key properties of 9-fluoro-9-phosphabicyclo[3.3.1]nonane?
9-fluoro-9-phosphabicyclo[3.3.1]nonane has a molecular weight of 160.17 g/mol, XLogP of 3.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluoro-9-phosphabicyclo[3.3.1]nonane is sourced from PubChem (CID 89001053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).