1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine

C6H10FNO5S2 — CID 12512488

IUPAC1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine
SMILESCS(C)(OS(=O)(=O)F)N1C(=O)CCC1=O
InChIInChI=1S/C6H10FNO5S2/c1-14(2,13-15(7,11)12)8-5(9)3-4-6(8)10/h3-4H2,1-2H3
InChIKeyZRZMSIDSAWASFK-UHFFFAOYSA-N
MW259.28 g/mol
LogP0.26
Rot. Bonds3

About 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine

1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine (PubChem CID 12512488) has the molecular formula C6H10FNO5S2 and a molecular weight of 259.28 g/mol. Its IUPAC name is 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine.

Molecular Properties

Compound Name1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine
PubChem CID12512488
Molecular FormulaC6H10FNO5S2
Molecular Weight259.28 g/mol
Exact Mass259.00
IUPAC Name1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine
SMILESCS(C)(OS(=O)(=O)F)N1C(=O)CCC1=O
InChIInChI=1S/C6H10FNO5S2/c1-14(2,13-15(7,11)12)8-5(9)3-4-6(8)10/h3-4H2,1-2H3
InChIKeyZRZMSIDSAWASFK-UHFFFAOYSA-N
XLogP0.26
TPSA80.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine?
The IUPAC name of 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine (CID 12512488) is 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine.
What is the SMILES notation for 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine?
The canonical SMILES for 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine is CS(C)(OS(=O)(=O)F)N1C(=O)CCC1=O.
What is the InChIKey of 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine?
The InChIKey is ZRZMSIDSAWASFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FNO5S2/c1-14(2,13-15(7,11)12)8-5(9)3-4-6(8)10/h3-4H2,1-2H3.
What are the key properties of 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine?
1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine has a molecular weight of 259.28 g/mol, XLogP of 0.26, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[fluorosulfonyloxy(dimethyl)-λ4-sulfanyl]-2,5-dioxopyrrolidine is sourced from PubChem (CID 12512488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).