2-methoxyethoxy hypofluorite

C3H7FO3 — CID 148549795

IUPAC2-methoxyethoxy hypofluorite
SMILESCOCCOOF
InChIInChI=1S/C3H7FO3/c1-5-2-3-6-7-4/h2-3H2,1H3
InChIKeyCTCCHKSGCBWINA-UHFFFAOYSA-N
MW110.08 g/mol
LogP0.47
Rot. Bonds4

About 2-methoxyethoxy hypofluorite

2-methoxyethoxy hypofluorite (PubChem CID 148549795) has the molecular formula C3H7FO3 and a molecular weight of 110.08 g/mol. Its IUPAC name is 2-methoxyethoxy hypofluorite.

Molecular Properties

Compound Name2-methoxyethoxy hypofluorite
PubChem CID148549795
Molecular FormulaC3H7FO3
Molecular Weight110.08 g/mol
Exact Mass110.04
IUPAC Name2-methoxyethoxy hypofluorite
SMILESCOCCOOF
InChIInChI=1S/C3H7FO3/c1-5-2-3-6-7-4/h2-3H2,1H3
InChIKeyCTCCHKSGCBWINA-UHFFFAOYSA-N
XLogP0.47
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.08
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyethoxy hypofluorite?
The IUPAC name of 2-methoxyethoxy hypofluorite (CID 148549795) is 2-methoxyethoxy hypofluorite.
What is the SMILES notation for 2-methoxyethoxy hypofluorite?
The canonical SMILES for 2-methoxyethoxy hypofluorite is COCCOOF.
What is the InChIKey of 2-methoxyethoxy hypofluorite?
The InChIKey is CTCCHKSGCBWINA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7FO3/c1-5-2-3-6-7-4/h2-3H2,1H3.
What are the key properties of 2-methoxyethoxy hypofluorite?
2-methoxyethoxy hypofluorite has a molecular weight of 110.08 g/mol, XLogP of 0.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethoxy hypofluorite is sourced from PubChem (CID 148549795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).