(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane

C8H14F2O — CID 89027013

IUPAC(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
SMILESCC[C@H]1OC(C)C(F)(F)[C@@H]1C
InChIInChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5-,6?,7-/m1/s1
InChIKeyGYHPTMCMNVNATA-YFBHCESUSA-N
MW164.19 g/mol
LogP2.46
Rot. Bonds1

About (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane

(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane (PubChem CID 89027013) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane.

Molecular Properties

Compound Name(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
PubChem CID89027013
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
SMILESCC[C@H]1OC(C)C(F)(F)[C@@H]1C
InChIInChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5-,6?,7-/m1/s1
InChIKeyGYHPTMCMNVNATA-YFBHCESUSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)oxolane
CID 13271513
cis-(1R,3S)-1-methyl-3-(2,2,2-trifluoroethoxy)cyclohexane
CID 21638556
trans-(1S,3S)-1-methyl-3-(2,2,2-trifluoroethoxy)cyclohexane
CID 21638557
1-Methyl-3-(2,2,2-trifluoroethoxy)cyclohexane
CID 73818635
[Ethoxy(difluoro)methyl]cyclopentane
CID 18725580
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
2,5-Diethyl-3-(trifluoromethyl)oxolane
CID 20771105
2,2-Difluoro-3,5-dimethyloxolane
CID 20802266
1-Methyl-4-(1,1,2,2-tetrafluoroethoxy)cyclohexane
CID 21137276
1-Methyl-4-(2,2,2-trifluoroethoxy)cyclohexane
CID 21137277
2,4-Diethyl-2,3,3,4,5,5-hexafluorooxolane
CID 21397503

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The IUPAC name of (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane (CID 89027013) is (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane.
What is the SMILES notation for (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The canonical SMILES for (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane is CC[C@H]1OC(C)C(F)(F)[C@@H]1C.
What is the InChIKey of (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The InChIKey is GYHPTMCMNVNATA-YFBHCESUSA-N. The full InChI is InChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5-,6?,7-/m1/s1.
What are the key properties of (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
(4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane has a molecular weight of 164.19 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane is sourced from PubChem (CID 89027013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).