2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane

C9H10F8O — CID 58731899

IUPAC2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane
SMILESCC1C(F)(F)OC(F)(C(C)(F)F)C1(F)C(C)(F)F
InChIInChI=1S/C9H10F8O/c1-4-7(14,5(2,10)11)9(17,6(3,12)13)18-8(4,15)16/h4H,1-3H3
InChIKeyLSLWHLRIFNMICK-UHFFFAOYSA-N
MW286.16 g/mol
LogP3.93
Rot. Bonds2

About 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane

2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane (PubChem CID 58731899) has the molecular formula C9H10F8O and a molecular weight of 286.16 g/mol. Its IUPAC name is 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane.

Molecular Properties

Compound Name2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane
PubChem CID58731899
Molecular FormulaC9H10F8O
Molecular Weight286.16 g/mol
Exact Mass286.06
IUPAC Name2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane
SMILESCC1C(F)(F)OC(F)(C(C)(F)F)C1(F)C(C)(F)F
InChIInChI=1S/C9H10F8O/c1-4-7(14,5(2,10)11)9(17,6(3,12)13)18-8(4,15)16/h4H,1-3H3
InChIKeyLSLWHLRIFNMICK-UHFFFAOYSA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.16
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-Butyl-2,2,3,4,4,5,5-heptafluorooxolane
CID 15788982
1,1,1,2,2,3,4,5,6,6,6-Undecafluoro-5-methoxy-3-methyl-4-propan-2-ylhexane
CID 19761923
2-Ethoxy-1,1,1,2,3,4,5,5,6,6,6-undecafluoro-4-methyl-3-propan-2-ylhexane
CID 19761925
5-Ethyl-2,2,3,3,5-pentafluoro-4-(fluoromethyl)oxolane
CID 20725476
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
2,5-Diethyl-3,4-bis(trifluoromethyl)oxolane
CID 20771104
5-(1,1-Difluoroethyl)-2,2,5-trifluoro-3-(fluoromethyl)oxolane
CID 20793160
2,3-Diethyl-2,3,4,4,5,5-hexafluorooxolane
CID 20802273
2,3-Bis(1,1-difluoroethyl)-2,3,4,4,5,5-hexafluorooxolane
CID 20823501
2,4-Diethyl-2,3,3,4,5,5-hexafluorooxolane
CID 21397503
2-[Difluoro(1,1,2-trifluoroethoxy)methyl]-1,1,1-trifluoro-4-(trifluoromethyl)hexane;fluoromethane
CID 54203988
2-[Difluoro(1,1,2-trifluoroethoxy)methyl]-1,1,1-trifluoro-4-(trifluoromethyl)hexane
CID 54203989

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane?
The IUPAC name of 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane (CID 58731899) is 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane.
What is the SMILES notation for 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane?
The canonical SMILES for 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane is CC1C(F)(F)OC(F)(C(C)(F)F)C1(F)C(C)(F)F.
What is the InChIKey of 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane?
The InChIKey is LSLWHLRIFNMICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F8O/c1-4-7(14,5(2,10)11)9(17,6(3,12)13)18-8(4,15)16/h4H,1-3H3.
What are the key properties of 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane?
2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane has a molecular weight of 286.16 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 2,3-bis(1,1-difluoroethyl)-2,3,5,5-tetrafluoro-4-methyloxolane is sourced from PubChem (CID 58731899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).