2-fluorooxyethyl hypofluorite

C2H4F2O2 — CID 18335874

IUPAC2-fluorooxyethyl hypofluorite
SMILESFOCCOF
InChIInChI=1S/C2H4F2O2/c3-5-1-2-6-4/h1-2H2
InChIKeyKRYPQIYFAKUCLU-UHFFFAOYSA-N
MW98.05 g/mol
LogP0.79
Rot. Bonds3

About 2-fluorooxyethyl hypofluorite

2-fluorooxyethyl hypofluorite (PubChem CID 18335874) has the molecular formula C2H4F2O2 and a molecular weight of 98.05 g/mol. Its IUPAC name is 2-fluorooxyethyl hypofluorite.

Molecular Properties

Compound Name2-fluorooxyethyl hypofluorite
PubChem CID18335874
Molecular FormulaC2H4F2O2
Molecular Weight98.05 g/mol
Exact Mass98.02
IUPAC Name2-fluorooxyethyl hypofluorite
SMILESFOCCOF
InChIInChI=1S/C2H4F2O2/c3-5-1-2-6-4/h1-2H2
InChIKeyKRYPQIYFAKUCLU-UHFFFAOYSA-N
XLogP0.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.05
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-fluorooxyethyl hypofluorite?
The IUPAC name of 2-fluorooxyethyl hypofluorite (CID 18335874) is 2-fluorooxyethyl hypofluorite.
What is the SMILES notation for 2-fluorooxyethyl hypofluorite?
The canonical SMILES for 2-fluorooxyethyl hypofluorite is FOCCOF.
What is the InChIKey of 2-fluorooxyethyl hypofluorite?
The InChIKey is KRYPQIYFAKUCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4F2O2/c3-5-1-2-6-4/h1-2H2.
What are the key properties of 2-fluorooxyethyl hypofluorite?
2-fluorooxyethyl hypofluorite has a molecular weight of 98.05 g/mol, XLogP of 0.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluorooxyethyl hypofluorite is sourced from PubChem (CID 18335874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).