2,5-diethyl-3,4-bis(trifluoromethyl)oxolane

C10H14F6O — CID 20771104

IUPAC2,5-diethyl-3,4-bis(trifluoromethyl)oxolane
SMILESCCC1OC(CC)C(C(F)(F)F)C1C(F)(F)F
InChIInChI=1S/C10H14F6O/c1-3-5-7(9(11,12)13)8(10(14,15)16)6(4-2)17-5/h5-8H,3-4H2,1-2H3
InChIKeySNOJLECRBXSJSV-UHFFFAOYSA-N
MW264.21 g/mol
LogP3.93
Rot. Bonds2

About 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane

2,5-diethyl-3,4-bis(trifluoromethyl)oxolane (PubChem CID 20771104) has the molecular formula C10H14F6O and a molecular weight of 264.21 g/mol. Its IUPAC name is 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane.

Molecular Properties

Compound Name2,5-diethyl-3,4-bis(trifluoromethyl)oxolane
PubChem CID20771104
Molecular FormulaC10H14F6O
Molecular Weight264.21 g/mol
Exact Mass264.09
IUPAC Name2,5-diethyl-3,4-bis(trifluoromethyl)oxolane
SMILESCCC1OC(CC)C(C(F)(F)F)C1C(F)(F)F
InChIInChI=1S/C10H14F6O/c1-3-5-7(9(11,12)13)8(10(14,15)16)6(4-2)17-5/h5-8H,3-4H2,1-2H3
InChIKeySNOJLECRBXSJSV-UHFFFAOYSA-N
XLogP3.93
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 ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Perfluorohexylethyl dimethylbutyl ether
CID 10874009
3-(5-Ethoxy-2,2,3,3-tetrafluoropentyl)-4-methyloxolane
CID 11778000
2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)oxolane
CID 13271513
3-(2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl)-4-methyloxolane
CID 85267668
3-Methyl-4-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptyl)oxolane
CID 101115659
3-Methyl-4-(2,2,3,3,4,4,5,5-octafluoropentyl)oxolane
CID 101115660
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
2,5-Diethyl-3-(trifluoromethyl)oxolane
CID 20771105
2-Ethyl-4-fluoro-3,5-dimethyloxolane
CID 23557851
(5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
CID 58685987
2,3-Bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane
CID 58731899
(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium
CID 58988393

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane?
The IUPAC name of 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane (CID 20771104) is 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane.
What is the SMILES notation for 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane?
The canonical SMILES for 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane is CCC1OC(CC)C(C(F)(F)F)C1C(F)(F)F.
What is the InChIKey of 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane?
The InChIKey is SNOJLECRBXSJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6O/c1-3-5-7(9(11,12)13)8(10(14,15)16)6(4-2)17-5/h5-8H,3-4H2,1-2H3.
What are the key properties of 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane?
2,5-diethyl-3,4-bis(trifluoromethyl)oxolane has a molecular weight of 264.21 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-3,4-bis(trifluoromethyl)oxolane is sourced from PubChem (CID 20771104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).