1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane

C7H4F10O — CID 58114492

IUPAC1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane
SMILESFC(F)COC1(F)C(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H4F10O/c8-2(9)1-18-5(13)3(10)4(11,12)6(14,15)7(5,16)17/h2-3H,1H2
InChIKeyDAFGXMQWFRRIDH-UHFFFAOYSA-N
MW294.09 g/mol
LogP3.19
Rot. Bonds3

About 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane

1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane (PubChem CID 58114492) has the molecular formula C7H4F10O and a molecular weight of 294.09 g/mol. Its IUPAC name is 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane.

Molecular Properties

Compound Name1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane
PubChem CID58114492
Molecular FormulaC7H4F10O
Molecular Weight294.09 g/mol
Exact Mass294.01
IUPAC Name1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane
SMILESFC(F)COC1(F)C(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H4F10O/c8-2(9)1-18-5(13)3(10)4(11,12)6(14,15)7(5,16)17/h2-3H,1H2
InChIKeyDAFGXMQWFRRIDH-UHFFFAOYSA-N
XLogP3.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.09
LogP ≤ 53.19
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-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane?
The IUPAC name of 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane (CID 58114492) is 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane.
What is the SMILES notation for 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane?
The canonical SMILES for 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane is FC(F)COC1(F)C(F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane?
The InChIKey is DAFGXMQWFRRIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F10O/c8-2(9)1-18-5(13)3(10)4(11,12)6(14,15)7(5,16)17/h2-3H,1H2.
What are the key properties of 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane?
1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane has a molecular weight of 294.09 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethoxy)-1,2,2,3,3,4,4,5-octafluorocyclopentane is sourced from PubChem (CID 58114492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).