CHEBI:36065 - (S)-halothane

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ChEBI Name (S)-halothane
ChEBI ID CHEBI:36065
ChEBI ASCII Name (S)-halothane
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C2HBrClF3
Net Charge 0
Average Mass 197.38125
Monoisotopic Mass 195.89022
InChI InChI=1S/C2HBrClF3/c3-1(4)2(5,6)7/h1H/t1-/m1/s1
InChIKey BCQZXOMGPXTTIC-PVQJCKRUSA-N
SMILES FC(F)(F)[C@@H](Cl)Br
Roles Classification
Application(s): inhalation anaesthetic

(via halothane )
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ChEBI Ontology
Outgoing (S)-halothane (CHEBI:36065) is a halothane (CHEBI:5615)
(S)-halothane (CHEBI:36065) is enantiomer of (R)-halothane (CHEBI:49646)
Incoming (R)-halothane (CHEBI:49646) is enantiomer of (S)-halothane (CHEBI:36065)
IUPAC Name
(2S)-2-bromo-2-chloro-1,1,1-trifluoroethane
Registry Number Type Source
9999460 Beilstein Registry Number Beilstein
Last Modified
26 June 2007