1-fluoro-2-(2-fluoroethoxy)ethane

C4H8F2O — CID 22164137

IUPAC1-fluoro-2-(2-fluoroethoxy)ethane
SMILESFCCOCCF
InChIInChI=1S/C4H8F2O/c5-1-3-7-4-2-6/h1-4H2
InChIKeyPEMRKDDXYZHSMU-UHFFFAOYSA-N
MW110.10 g/mol
LogP0.94
Rot. Bonds4

About 1-fluoro-2-(2-fluoroethoxy)ethane

1-fluoro-2-(2-fluoroethoxy)ethane (PubChem CID 22164137) has the molecular formula C4H8F2O and a molecular weight of 110.10 g/mol. Its IUPAC name is 1-fluoro-2-(2-fluoroethoxy)ethane.

Molecular Properties

Compound Name1-fluoro-2-(2-fluoroethoxy)ethane
PubChem CID22164137
Molecular FormulaC4H8F2O
Molecular Weight110.10 g/mol
Exact Mass110.05
IUPAC Name1-fluoro-2-(2-fluoroethoxy)ethane
SMILESFCCOCCF
InChIInChI=1S/C4H8F2O/c5-1-3-7-4-2-6/h1-4H2
InChIKeyPEMRKDDXYZHSMU-UHFFFAOYSA-N
XLogP0.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.10
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(2-fluoroethoxy)ethane?
The IUPAC name of 1-fluoro-2-(2-fluoroethoxy)ethane (CID 22164137) is 1-fluoro-2-(2-fluoroethoxy)ethane.
What is the SMILES notation for 1-fluoro-2-(2-fluoroethoxy)ethane?
The canonical SMILES for 1-fluoro-2-(2-fluoroethoxy)ethane is FCCOCCF.
What is the InChIKey of 1-fluoro-2-(2-fluoroethoxy)ethane?
The InChIKey is PEMRKDDXYZHSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F2O/c5-1-3-7-4-2-6/h1-4H2.
What are the key properties of 1-fluoro-2-(2-fluoroethoxy)ethane?
1-fluoro-2-(2-fluoroethoxy)ethane has a molecular weight of 110.10 g/mol, XLogP of 0.94, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(2-fluoroethoxy)ethane is sourced from PubChem (CID 22164137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).