EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:231898 - (5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one

ChEBI IDCHEBI:231898
ChEBI Name(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one
Stars
ASCII Name(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one
DefinitionA difluorobenzene that is benzene substituted by (5R)-4,5-dimethyl-2-oxo-5-(trifluoromethyl)tetrahydrofuran-3-yl, methoxy, fluoro, and fluoro groups at positions 1, 2, 3 and 4, respectively.
Last Modified5 September 2024
SubmitterAdnan
DownloadsMolfile
FormulaC14H13F5O3
Net Charge0
Average Mass324.245
Monoisotopic Mass324.07849
SMILESCOc1c(C2C(=O)O[C@@](C)(C(F)(F)F)C2C)ccc(F)c1F
InChIInChI=1S/C14H13F5O3/c1-6-9(12(20)22-13(6,2)14(17,18)19)7-4-5-8(15)10(16)11(7)21-3/h4-6,9H,1-3H3/t6?,9?,13-/m1/s1
InChIKeyHBCSXUVNZQVYRB-BUDIUTNSSA-N
ChEBI Ontology
Outgoing Relation(s)
(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one (CHEBI:231898) is a butan-4-olide (CHEBI:22950)
(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one (CHEBI:231898) is a difluorobenzene (CHEBI:38582)
(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one (CHEBI:231898) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
(5R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-one
Synonym  Source
(R)-3-(3,4-difluoro-2-methoxyphenyl)-4,5-dimethyl-5-(trifluoromethyl)dihydrofuran-2(3H)-oneChEBI
Registry NumbersSources
CAS:2875066-38-7ChEBI