(3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol

C8H15FO2 — CID 118594425

IUPAC(3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol
SMILESCC[C@@]1(C)OC(O)[C@H](F)[C@@H]1C
InChIInChI=1S/C8H15FO2/c1-4-8(3)5(2)6(9)7(10)11-8/h5-7,10H,4H2,1-3H3/t5-,6+,7?,8+/m0/s1
InChIKeyQKGFAYUJONYUDP-CZLDRYSHSA-N
MW162.20 g/mol
LogP1.48
Rot. Bonds1

About (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol

(3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol (PubChem CID 118594425) has the molecular formula C8H15FO2 and a molecular weight of 162.20 g/mol. Its IUPAC name is (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol.

Molecular Properties

Compound Name(3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol
PubChem CID118594425
Molecular FormulaC8H15FO2
Molecular Weight162.20 g/mol
Exact Mass162.11
IUPAC Name(3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol
SMILESCC[C@@]1(C)OC(O)[C@H](F)[C@@H]1C
InChIInChI=1S/C8H15FO2/c1-4-8(3)5(2)6(9)7(10)11-8/h5-7,10H,4H2,1-3H3/t5-,6+,7?,8+/m0/s1
InChIKeyQKGFAYUJONYUDP-CZLDRYSHSA-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 (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol?
The IUPAC name of (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol (CID 118594425) is (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol.
What is the SMILES notation for (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol?
The canonical SMILES for (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol is CC[C@@]1(C)OC(O)[C@H](F)[C@@H]1C.
What is the InChIKey of (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol?
The InChIKey is QKGFAYUJONYUDP-CZLDRYSHSA-N. The full InChI is InChI=1S/C8H15FO2/c1-4-8(3)5(2)6(9)7(10)11-8/h5-7,10H,4H2,1-3H3/t5-,6+,7?,8+/m0/s1.
What are the key properties of (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol?
(3R,4R,5R)-5-ethyl-3-fluoro-4,5-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 (3R,4R,5R)-5-ethyl-3-fluoro-4,5-dimethyloxolan-2-ol is sourced from PubChem (CID 118594425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).