2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane

C10H14F6O — CID 129303998

IUPAC2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane
SMILESCCC(C)(C)C1(F)OC(F)(F)C(F)(F)C1(C)F
InChIInChI=1S/C10H14F6O/c1-5-6(2,3)9(14)7(4,11)8(12,13)10(15,16)17-9/h5H2,1-4H3
InChIKeySDZBICAUADSWFD-UHFFFAOYSA-N
MW264.21 g/mol
LogP4.07
Rot. Bonds2

About 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane

2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane (PubChem CID 129303998) has the molecular formula C10H14F6O and a molecular weight of 264.21 g/mol. Its IUPAC name is 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane.

Molecular Properties

Compound Name2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane
PubChem CID129303998
Molecular FormulaC10H14F6O
Molecular Weight264.21 g/mol
Exact Mass264.09
IUPAC Name2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane
SMILESCCC(C)(C)C1(F)OC(F)(F)C(F)(F)C1(C)F
InChIInChI=1S/C10H14F6O/c1-5-6(2,3)9(14)7(4,11)8(12,13)10(15,16)17-9/h5H2,1-4H3
InChIKeySDZBICAUADSWFD-UHFFFAOYSA-N
XLogP4.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.21
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)oxolane
CID 13271513
3-Butyl-2,2,3,4,4,5,5-heptafluorooxolane
CID 15788982
2,3-Diethyl-2,3,4,4,5,5-hexafluorooxolane
CID 20802273
2,4-Diethyl-2,3,3,4,5,5-hexafluorooxolane
CID 21397503
5-(1,1-Difluoroethyl)-3-ethyl-2,3,5-trifluoro-2-(trifluoromethyl)oxolane
CID 58488791
5-(1,1-Difluoroethyl)-3-ethyl-2,2,3,5-tetrafluorooxolane
CID 58488792
2-(1,1-Difluoroethyl)-3-ethyl-2,3,4,4,5,5-hexafluorooxolane
CID 58571395
2,4,4-Trifluoro-3-(fluoromethyl)-2,3,5,5-tetramethyloxolane
CID 58637699
2-Tert-butyl-3,3-difluoro-2,4,4,5,5-pentamethyloxolane
CID 58637725
2,2,3,4,4,5-Hexafluoro-3,5-dipropyloxolane
CID 87671787
2-(1,1-Difluoro-2-methylpropyl)-2,3,4,5,5-pentafluoro-3-(trifluoromethyl)oxolane
CID 88871638
2-(1,1-Difluoro-2,2-dimethylbutyl)-2,3,4,5,5-pentafluoro-3-(trifluoromethyl)oxolane
CID 88896174

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane?
The IUPAC name of 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane (CID 129303998) is 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane.
What is the SMILES notation for 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane?
The canonical SMILES for 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane is CCC(C)(C)C1(F)OC(F)(F)C(F)(F)C1(C)F.
What is the InChIKey of 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane?
The InChIKey is SDZBICAUADSWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6O/c1-5-6(2,3)9(14)7(4,11)8(12,13)10(15,16)17-9/h5H2,1-4H3.
What are the key properties of 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane?
2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane has a molecular weight of 264.21 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,5-hexafluoro-4-methyl-5-(2-methylbutan-2-yl)oxolane is sourced from PubChem (CID 129303998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).