2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane

C9H8F8O — CID 13451002

IUPAC2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane
SMILESFC1C(F)(F)C(F)(F)C(F)(F)C1(F)C1CCCO1
InChIInChI=1S/C9H8F8O/c10-5-6(11,4-2-1-3-18-4)8(14,15)9(16,17)7(5,12)13/h4-5H,1-3H2
InChIKeyWPCQMOJTVICPJR-UHFFFAOYSA-N
MW284.15 g/mol
LogP3.13
Rot. Bonds1

About 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane

2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane (PubChem CID 13451002) has the molecular formula C9H8F8O and a molecular weight of 284.15 g/mol. Its IUPAC name is 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane.

Molecular Properties

Compound Name2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane
PubChem CID13451002
Molecular FormulaC9H8F8O
Molecular Weight284.15 g/mol
Exact Mass284.04
IUPAC Name2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane
SMILESFC1C(F)(F)C(F)(F)C(F)(F)C1(F)C1CCCO1
InChIInChI=1S/C9H8F8O/c10-5-6(11,4-2-1-3-18-4)8(14,15)9(16,17)7(5,12)13/h4-5H,1-3H2
InChIKeyWPCQMOJTVICPJR-UHFFFAOYSA-N
XLogP3.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)oxolane
CID 13271513
2-(1,2,2,3,3,4,4,5-Octafluorocyclopentyl)oxane
CID 13451009
2-(1,2,2,3,3,4,4,5-Octafluorocyclopentyl)oxepane
CID 13451016
2-(1,1,1,2,3,3,4,4,4-Nonafluorobutan-2-yl)oxolane
CID 21967075
2,2-Bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)oxolane
CID 23328478
5-Ethyl-2,3-difluoro-2,3-bis(trifluoromethyl)oxolane
CID 146536173
5-Ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane
CID 146536174
5-Ethyl-2,3-difluoro-3-methyl-2-(trifluoromethyl)oxolane
CID 146536175
3-Fluoro-1-oxaspiro[4.4]nonane
CID 156730672
1-Ethyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctoxy)cyclopentane
CID 173379739
1-Ethyl-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctoxy)cyclopentane
CID 173379753
2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)-5-[2-[3-(trifluoromethyl)cyclopentyl]ethyl]oxolane
CID 173500457

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane?
The IUPAC name of 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane (CID 13451002) is 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane.
What is the SMILES notation for 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane?
The canonical SMILES for 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane is FC1C(F)(F)C(F)(F)C(F)(F)C1(F)C1CCCO1.
What is the InChIKey of 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane?
The InChIKey is WPCQMOJTVICPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F8O/c10-5-6(11,4-2-1-3-18-4)8(14,15)9(16,17)7(5,12)13/h4-5H,1-3H2.
What are the key properties of 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane?
2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane has a molecular weight of 284.15 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)oxolane is sourced from PubChem (CID 13451002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).