2,2-Dimethyl-5-oxo-2,5-dihydrofuran-3-yl trifluoromethanesulfonate

HCID 58926348
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1(C)OC(=O)C=C1OS(=O)(=O)C(F)(F)F
InChIKey
RBXBWTKZFXCXCE-UHFFFAOYSA-N
Molecular formula
C7H7F3O5S
Average molar mass
260.19 g/mol
Monoisotopic mass
259.99662898

Names & identifiers

Preferred name
2,2-Dimethyl-5-oxo-2,5-dihydrofuran-3-yl trifluoromethanesulfonate
IUPAC
(2,2-dimethyl-5-oxofuran-3-yl) trifluoromethanesulfonate

Names & synonyms

2,2-dimethyl-5-oxo-2,5-dihydrofuran-3-yl trifluoromethanesulfonateSCHEMBL5316405

Database identifiers

PubChem CID
58926348

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
78.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
16

Related reactions

8 records
New reaction record

Compound notes

Loading…