2-(2-fluoroethoxymethyl)oxirane

C5H9FO2 — CID 14571127

IUPAC2-(2-fluoroethoxymethyl)oxirane
SMILESFCCOCC1CO1
InChIInChI=1S/C5H9FO2/c6-1-2-7-3-5-4-8-5/h5H,1-4H2
InChIKeyQZFKARGOHMIZOH-UHFFFAOYSA-N
MW120.12 g/mol
LogP0.37
Rot. Bonds4

About 2-(2-fluoroethoxymethyl)oxirane

2-(2-fluoroethoxymethyl)oxirane (PubChem CID 14571127) has the molecular formula C5H9FO2 and a molecular weight of 120.12 g/mol. Its IUPAC name is 2-(2-fluoroethoxymethyl)oxirane.

Molecular Properties

Compound Name2-(2-fluoroethoxymethyl)oxirane
PubChem CID14571127
Molecular FormulaC5H9FO2
Molecular Weight120.12 g/mol
Exact Mass120.06
IUPAC Name2-(2-fluoroethoxymethyl)oxirane
SMILESFCCOCC1CO1
InChIInChI=1S/C5H9FO2/c6-1-2-7-3-5-4-8-5/h5H,1-4H2
InChIKeyQZFKARGOHMIZOH-UHFFFAOYSA-N
XLogP0.37
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.12
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethoxymethyl)oxirane?
The IUPAC name of 2-(2-fluoroethoxymethyl)oxirane (CID 14571127) is 2-(2-fluoroethoxymethyl)oxirane.
What is the SMILES notation for 2-(2-fluoroethoxymethyl)oxirane?
The canonical SMILES for 2-(2-fluoroethoxymethyl)oxirane is FCCOCC1CO1.
What is the InChIKey of 2-(2-fluoroethoxymethyl)oxirane?
The InChIKey is QZFKARGOHMIZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO2/c6-1-2-7-3-5-4-8-5/h5H,1-4H2.
What are the key properties of 2-(2-fluoroethoxymethyl)oxirane?
2-(2-fluoroethoxymethyl)oxirane has a molecular weight of 120.12 g/mol, XLogP of 0.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethoxymethyl)oxirane is sourced from PubChem (CID 14571127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).