1,2,2,3,3,3-hexafluoropropoxycyclopentane

C8H10F6O — CID 54301935

IUPAC1,2,2,3,3,3-hexafluoropropoxycyclopentane
SMILESFC(OC1CCCC1)C(F)(F)C(F)(F)F
InChIInChI=1S/C8H10F6O/c9-6(7(10,11)8(12,13)14)15-5-3-1-2-4-5/h5-6H,1-4H2
InChIKeyUILUXXBBOMHEIJ-UHFFFAOYSA-N
MW236.15 g/mol
LogP3.44
Rot. Bonds3

About 1,2,2,3,3,3-hexafluoropropoxycyclopentane

1,2,2,3,3,3-hexafluoropropoxycyclopentane (PubChem CID 54301935) has the molecular formula C8H10F6O and a molecular weight of 236.15 g/mol. Its IUPAC name is 1,2,2,3,3,3-hexafluoropropoxycyclopentane.

Molecular Properties

Compound Name1,2,2,3,3,3-hexafluoropropoxycyclopentane
PubChem CID54301935
Molecular FormulaC8H10F6O
Molecular Weight236.15 g/mol
Exact Mass236.06
IUPAC Name1,2,2,3,3,3-hexafluoropropoxycyclopentane
SMILESFC(OC1CCCC1)C(F)(F)C(F)(F)F
InChIInChI=1S/C8H10F6O/c9-6(7(10,11)8(12,13)14)15-5-3-1-2-4-5/h5-6H,1-4H2
InChIKeyUILUXXBBOMHEIJ-UHFFFAOYSA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.15
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,3,3-hexafluoropropoxycyclopentane?
The IUPAC name of 1,2,2,3,3,3-hexafluoropropoxycyclopentane (CID 54301935) is 1,2,2,3,3,3-hexafluoropropoxycyclopentane.
What is the SMILES notation for 1,2,2,3,3,3-hexafluoropropoxycyclopentane?
The canonical SMILES for 1,2,2,3,3,3-hexafluoropropoxycyclopentane is FC(OC1CCCC1)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,2,2,3,3,3-hexafluoropropoxycyclopentane?
The InChIKey is UILUXXBBOMHEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F6O/c9-6(7(10,11)8(12,13)14)15-5-3-1-2-4-5/h5-6H,1-4H2.
What are the key properties of 1,2,2,3,3,3-hexafluoropropoxycyclopentane?
1,2,2,3,3,3-hexafluoropropoxycyclopentane has a molecular weight of 236.15 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,3,3-hexafluoropropoxycyclopentane is sourced from PubChem (CID 54301935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).