Isoflurane 3D structure

Isoflurane (also called 1-Chloro-2,2,2-trifluoroethyl difluoromethyl ether, Forane) has the formula C3H2ClF5O and a molar mass of 184.49 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C3H2ClF5O
Molar mass
184.49 g/mol
PubChem CID
3763
Heavy atoms
10
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name2-chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane
SMILESC(C(F)(F)F)(OC(F)F)Cl
PubChem CID3763
Other names1-Chloro-2,2,2-trifluoroethyl difluoromethyl ether, Forane, Forene, Aerrane, Isoflurano

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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