2-fluoroethoxymethyl hypofluorite

C3H6F2O2 — CID 59819071

IUPAC2-fluoroethoxymethyl hypofluorite
SMILESFCCOCOF
InChIInChI=1S/C3H6F2O2/c4-1-2-6-3-7-5/h1-3H2
InChIKeyJEPDNMIGGBIEER-UHFFFAOYSA-N
MW112.08 g/mol
LogP0.83
Rot. Bonds4

About 2-fluoroethoxymethyl hypofluorite

2-fluoroethoxymethyl hypofluorite (PubChem CID 59819071) has the molecular formula C3H6F2O2 and a molecular weight of 112.08 g/mol. Its IUPAC name is 2-fluoroethoxymethyl hypofluorite.

Molecular Properties

Compound Name2-fluoroethoxymethyl hypofluorite
PubChem CID59819071
Molecular FormulaC3H6F2O2
Molecular Weight112.08 g/mol
Exact Mass112.03
IUPAC Name2-fluoroethoxymethyl hypofluorite
SMILESFCCOCOF
InChIInChI=1S/C3H6F2O2/c4-1-2-6-3-7-5/h1-3H2
InChIKeyJEPDNMIGGBIEER-UHFFFAOYSA-N
XLogP0.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.08
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoroethoxymethyl hypofluorite?
The IUPAC name of 2-fluoroethoxymethyl hypofluorite (CID 59819071) is 2-fluoroethoxymethyl hypofluorite.
What is the SMILES notation for 2-fluoroethoxymethyl hypofluorite?
The canonical SMILES for 2-fluoroethoxymethyl hypofluorite is FCCOCOF.
What is the InChIKey of 2-fluoroethoxymethyl hypofluorite?
The InChIKey is JEPDNMIGGBIEER-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6F2O2/c4-1-2-6-3-7-5/h1-3H2.
What are the key properties of 2-fluoroethoxymethyl hypofluorite?
2-fluoroethoxymethyl hypofluorite has a molecular weight of 112.08 g/mol, XLogP of 0.83, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethoxymethyl hypofluorite is sourced from PubChem (CID 59819071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).