5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol

C8H15FO2 — CID 76797897

IUPAC5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol
SMILESCCC1OC(O)C(C)(F)C1C
InChIInChI=1S/C8H15FO2/c1-4-6-5(2)8(3,9)7(10)11-6/h5-7,10H,4H2,1-3H3
InChIKeyRZVIDMXIWKTOTB-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.48
Rot. Bonds1

About 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol

5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol (PubChem CID 76797897) has the molecular formula C8H15FO2 and a molecular weight of 162.20 g/mol. Its IUPAC name is 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol.

Molecular Properties

Compound Name5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol
PubChem CID76797897
Molecular FormulaC8H15FO2
Molecular Weight162.20 g/mol
Exact Mass162.11
IUPAC Name5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol
SMILESCCC1OC(O)C(C)(F)C1C
InChIInChI=1S/C8H15FO2/c1-4-6-5(2)8(3,9)7(10)11-6/h5-7,10H,4H2,1-3H3
InChIKeyRZVIDMXIWKTOTB-UHFFFAOYSA-N
XLogP1.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol?
The IUPAC name of 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol (CID 76797897) is 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol.
What is the SMILES notation for 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol?
The canonical SMILES for 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol is CCC1OC(O)C(C)(F)C1C.
What is the InChIKey of 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol?
The InChIKey is RZVIDMXIWKTOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FO2/c1-4-6-5(2)8(3,9)7(10)11-6/h5-7,10H,4H2,1-3H3.
What are the key properties of 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol?
5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol has a molecular weight of 162.20 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-fluoro-3,4-dimethyloxolan-2-ol is sourced from PubChem (CID 76797897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).