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(2-Oxooxolan-3-yl) trifluoromethanesulfonate

HCID 72293389
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1OCCC1OS(=O)(=O)C(F)(F)F
InChIKey
QOEKAXKDLQCASA-UHFFFAOYSA-N
Molecular formula
C5H5F3O5S
Average molar mass
234.15 g/mol

Names & identifiers

Preferred name
(2-Oxooxolan-3-yl) trifluoromethanesulfonate
IUPAC
(2-oxooxolan-3-yl) trifluoromethanesulfonate

Names & synonyms

SCHEMBL2767545QOEKAXKDLQCASA-UHFFFAOYSA-N(2-oxooxolan-3-yl) trifluoromethanesulfonate

Database identifiers

PubChem CID
72293389

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
78.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
326

Related reactions

2 records
New reaction record
HRID 143967 reaction equation
HRID 143967As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 176094 reaction equation
HRID 176094As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

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