(2,5-dioxopyrrolidin-1-yl) hypofluorite

C4H4FNO3 — CID 143099393

IUPAC(2,5-dioxopyrrolidin-1-yl) hypofluorite
SMILESO=C1CCC(=O)N1OF
InChIInChI=1S/C4H4FNO3/c5-9-6-3(7)1-2-4(6)8/h1-2H2
InChIKeyOXQCOGSENRWTKQ-UHFFFAOYSA-N
MW133.08 g/mol
LogP-0.05
Rot. Bonds1

About (2,5-dioxopyrrolidin-1-yl) hypofluorite

(2,5-dioxopyrrolidin-1-yl) hypofluorite (PubChem CID 143099393) has the molecular formula C4H4FNO3 and a molecular weight of 133.08 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) hypofluorite.

Molecular Properties

Compound Name(2,5-dioxopyrrolidin-1-yl) hypofluorite
PubChem CID143099393
Molecular FormulaC4H4FNO3
Molecular Weight133.08 g/mol
Exact Mass133.02
IUPAC Name(2,5-dioxopyrrolidin-1-yl) hypofluorite
SMILESO=C1CCC(=O)N1OF
InChIInChI=1S/C4H4FNO3/c5-9-6-3(7)1-2-4(6)8/h1-2H2
InChIKeyOXQCOGSENRWTKQ-UHFFFAOYSA-N
XLogP-0.05
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.08
LogP ≤ 5-0.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) hypofluorite?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) hypofluorite (CID 143099393) is (2,5-dioxopyrrolidin-1-yl) hypofluorite.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) hypofluorite?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) hypofluorite is O=C1CCC(=O)N1OF.
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) hypofluorite?
The InChIKey is OXQCOGSENRWTKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4FNO3/c5-9-6-3(7)1-2-4(6)8/h1-2H2.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) hypofluorite?
(2,5-dioxopyrrolidin-1-yl) hypofluorite has a molecular weight of 133.08 g/mol, XLogP of -0.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) hypofluorite is sourced from PubChem (CID 143099393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).