Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:6015 - isoflurane
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
isoflurane
ChEBI ID
CHEBI:6015
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Wikipedia
License
Read full article at Wikipedia
Formula
C3H2ClF5O
Net Charge
0
Average Mass
184.49210
Monoisotopic Mass
183.97143
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
View more via ChEBI Ontology
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
Manual Xrefs
Databases
1493
DrugCentral
1804
VSDB
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
ChemIDplus
26675-46-7
CAS Registry Number
NIST Chemistry WebBook
Last Modified
22 February 2017