4-ethyl-5-(2-fluoroethyl)oxolan-3-one

C8H13FO2 — CID 143850140

IUPAC4-ethyl-5-(2-fluoroethyl)oxolan-3-one
SMILESCCC1C(=O)COC1CCF
InChIInChI=1S/C8H13FO2/c1-2-6-7(10)5-11-8(6)3-4-9/h6,8H,2-5H2,1H3
InChIKeyOUISCSFWFYDSRL-UHFFFAOYSA-N
MW160.19 g/mol
LogP1.34
Rot. Bonds3

About 4-ethyl-5-(2-fluoroethyl)oxolan-3-one

4-ethyl-5-(2-fluoroethyl)oxolan-3-one (PubChem CID 143850140) has the molecular formula C8H13FO2 and a molecular weight of 160.19 g/mol. Its IUPAC name is 4-ethyl-5-(2-fluoroethyl)oxolan-3-one.

Molecular Properties

Compound Name4-ethyl-5-(2-fluoroethyl)oxolan-3-one
PubChem CID143850140
Molecular FormulaC8H13FO2
Molecular Weight160.19 g/mol
Exact Mass160.09
IUPAC Name4-ethyl-5-(2-fluoroethyl)oxolan-3-one
SMILESCCC1C(=O)COC1CCF
InChIInChI=1S/C8H13FO2/c1-2-6-7(10)5-11-8(6)3-4-9/h6,8H,2-5H2,1H3
InChIKeyOUISCSFWFYDSRL-UHFFFAOYSA-N
XLogP1.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.19
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-(2-fluoroethyl)oxolan-3-one?
The IUPAC name of 4-ethyl-5-(2-fluoroethyl)oxolan-3-one (CID 143850140) is 4-ethyl-5-(2-fluoroethyl)oxolan-3-one.
What is the SMILES notation for 4-ethyl-5-(2-fluoroethyl)oxolan-3-one?
The canonical SMILES for 4-ethyl-5-(2-fluoroethyl)oxolan-3-one is CCC1C(=O)COC1CCF.
What is the InChIKey of 4-ethyl-5-(2-fluoroethyl)oxolan-3-one?
The InChIKey is OUISCSFWFYDSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13FO2/c1-2-6-7(10)5-11-8(6)3-4-9/h6,8H,2-5H2,1H3.
What are the key properties of 4-ethyl-5-(2-fluoroethyl)oxolan-3-one?
4-ethyl-5-(2-fluoroethyl)oxolan-3-one has a molecular weight of 160.19 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-(2-fluoroethyl)oxolan-3-one is sourced from PubChem (CID 143850140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).