(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane

C7H13FO — CID 130460516

IUPAC(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane
SMILESCC[C@@H]1C[C@@](C)(F)CO1
InChIInChI=1S/C7H13FO/c1-3-6-4-7(2,8)5-9-6/h6H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeyFQDZNIQVTCIPJR-RNFRBKRXSA-N
MW132.18 g/mol
LogP1.91
Rot. Bonds1

About (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane

(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane (PubChem CID 130460516) has the molecular formula C7H13FO and a molecular weight of 132.18 g/mol. Its IUPAC name is (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane.

Molecular Properties

Compound Name(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane
PubChem CID130460516
Molecular FormulaC7H13FO
Molecular Weight132.18 g/mol
Exact Mass132.10
IUPAC Name(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane
SMILESCC[C@@H]1C[C@@](C)(F)CO1
InChIInChI=1S/C7H13FO/c1-3-6-4-7(2,8)5-9-6/h6H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeyFQDZNIQVTCIPJR-RNFRBKRXSA-N
XLogP1.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane?
The IUPAC name of (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane (CID 130460516) is (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane.
What is the SMILES notation for (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane?
The canonical SMILES for (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane is CC[C@@H]1C[C@@](C)(F)CO1.
What is the InChIKey of (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane?
The InChIKey is FQDZNIQVTCIPJR-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H13FO/c1-3-6-4-7(2,8)5-9-6/h6H,3-5H2,1-2H3/t6-,7-/m1/s1.
What are the key properties of (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane?
(2R,4R)-2-ethyl-4-fluoro-4-methyloxolane has a molecular weight of 132.18 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-2-ethyl-4-fluoro-4-methyloxolane is sourced from PubChem (CID 130460516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).