Molecular Identity
isoflurane
2-chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane
PubChem CID: 3763
Isoflurane is an organofluorine compound. It has a role as an inhalation anaesthetic. It is functionally related to a methoxyethane.
2D Structure
Properties
C3H2ClF5O
Molecular Formula
184.49
Molecular Weight
g/mol
183.9714
Exact Mass
Da
2.1
XLogP
Drug-like (Lipinski: < 5)
9.2
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
6
H-Bond Acceptors
102
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
isoflurane26675-46-71-Chloro-2,2,2-trifluoroethyl difluoromethyl etherForane2-Chloro-2-(difluoromethoxy)-1,1,1-trifluoroethaneForeneAerraneIsofluranoCompound 469IsoFloIsofluranumEthane, 2-chloro-2-(difluoromethoxy)-1,1,1-trifluoro-TerrellDTXSID3020752CYS9AKD70P
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to isoflurane
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