CHEBI:6015 - isoflurane

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ChEBI Name isoflurane
ChEBI ID CHEBI:6015
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C3H2ClF5O
Net Charge 0
Average Mass 184.49210
Monoisotopic Mass 183.971
InChI InChI=1S/C3H2ClF5O/c4-1(3(7,8)9)10-2(5)6/h1-2H
InChIKey PIWKPBJCKXDKJR-UHFFFAOYSA-N
SMILES FC(F)OC(Cl)C(F)(F)F
Roles Classification
Application(s): inhalation anaesthetic

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ChEBI Ontology
Outgoing isoflurane (CHEBI:6015) has functional parent methoxyethane (CHEBI:39832)
isoflurane (CHEBI:6015) has role inhalation anaesthetic (CHEBI:38870)
isoflurane (CHEBI:6015) is a organofluorine compound (CHEBI:37143)
IUPAC Name
2-chloro-2-difluoromethoxy-1,1,1-trifluoroethane
INNs Sources
isoflurane ChemIDplus
isoflurano ChemIDplus
isofluranum ChemIDplus
Synonyms Sources
1-chloro-2,2,2-trifluoroethyl difluoromethyl ether NIST Chemistry WebBook
Isoflurane KEGG COMPOUND
Brand Names Sources
Aerrane DrugBank
Ethane DrugBank
Forane DrugBank
Forene DrugBank
Database Links Databases
1493 DrugCentral
C07518 KEGG COMPOUND
D00545 KEGG DRUG
DB00753 DrugBank
Isoflurane Wikipedia
View more database links
Registry Numbers Types Sources
26675-46-7 CAS Registry Number KEGG COMPOUND
26675-46-7 CAS Registry Number NIST Chemistry WebBook
26675-46-7 CAS Registry Number ChemIDplus
Last Modified
22 February 2017