desflurane   

GtoPdb Ligand ID: 7156

Synonyms: I-653 | Suprane®
desflurane is an approved drug (FDA (1992))
Compound class: Synthetic organic
Comment: Desflurane is a highly fluorinated methyl ethyl ether general anaesthetic. it is a racemic mixture of (R) and (S) optical isomers (enantiomers). We show the chemical structure without specified stereochemistry to represent the mixture. Desflurane is a greenhouse gas.
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2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 9.23
Molecular weight 168
XLogP 2.47
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES FC(OC(C(F)(F)F)F)F
Isomeric SMILES FC(OC(C(F)(F)F)F)F
InChI InChI=1S/C3H2F6O/c4-1(3(7,8)9)10-2(5)6/h1-2H
InChI Key DPYMFVXJLLWWEU-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1992))
IUPAC Name
2-(difluoromethoxy)-1,1,1,2-tetrafluoroethane
International Nonproprietary Names
INN number INN
6505 desflurane
Synonyms
I-653 | Suprane®
Database Links
CAS Registry No. 57041-67-5
ChEMBL Ligand CHEMBL1200733
DrugBank Ligand DB01189
DrugCentral Ligand 811
GtoPdb PubChem SID 178103731
PubChem CID 42113
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Wikipedia Desflurane