(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane

C7H5F9O — CID 89213921

IUPAC(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C[C@@H]1CO1
InChIInChI=1S/C7H5F9O/c8-4(9,1-3-2-17-3)5(10,11)6(12,13)7(14,15)16/h3H,1-2H2/t3-/m1/s1
InChIKeyWUKHWLIEBSRTRH-GSVOUGTGSA-N
MW276.10 g/mol
LogP3.24
Rot. Bonds4

About (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane

(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane (PubChem CID 89213921) has the molecular formula C7H5F9O and a molecular weight of 276.10 g/mol. Its IUPAC name is (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane.

Molecular Properties

Compound Name(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane
PubChem CID89213921
Molecular FormulaC7H5F9O
Molecular Weight276.10 g/mol
Exact Mass276.02
IUPAC Name(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C[C@@H]1CO1
InChIInChI=1S/C7H5F9O/c8-4(9,1-3-2-17-3)5(10,11)6(12,13)7(14,15)16/h3H,1-2H2/t3-/m1/s1
InChIKeyWUKHWLIEBSRTRH-GSVOUGTGSA-N
XLogP3.24
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.10
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane?
The IUPAC name of (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane (CID 89213921) is (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane.
What is the SMILES notation for (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane?
The canonical SMILES for (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane is FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C[C@@H]1CO1.
What is the InChIKey of (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane?
The InChIKey is WUKHWLIEBSRTRH-GSVOUGTGSA-N. The full InChI is InChI=1S/C7H5F9O/c8-4(9,1-3-2-17-3)5(10,11)6(12,13)7(14,15)16/h3H,1-2H2/t3-/m1/s1.
What are the key properties of (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane?
(2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane has a molecular weight of 276.10 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)oxirane is sourced from PubChem (CID 89213921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).