Sevoflurane

C₄H₃F₇O — CID 5206

About Sevoflurane

Sevoflurane (PubChem CID 5206) has the molecular formula C₄H₃F₇O and a molecular weight of 200.05 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane.

Molecular Properties

• Compound Name: Sevoflurane
• PubChem CID: 5206
• Molecular Formula: C₄H₃F₇O
• Molecular Weight: 200.05 g/mol
• Exact Mass: 200.01
• IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane
• SMILES: FCOC(C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C4H3F7O/c5-1-12-2(3(6,7)8)4(9,10)11/h2H,1H2
• InChIKey: DFEYYRMXOJXZRJ-UHFFFAOYSA-N
• XLogP: 2.42
• TPSA: 9.23 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	200.05
LogP ≤ 5	2.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of Sevoflurane?

The IUPAC name of Sevoflurane (CID 5206) is 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane.

What is the SMILES notation for Sevoflurane?

The canonical SMILES for Sevoflurane is FCOC(C(F)(F)F)C(F)(F)F.

What is the InChIKey of Sevoflurane?

The InChIKey is DFEYYRMXOJXZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F7O/c5-1-12-2(3(6,7)8)4(9,10)11/h2H,1H2.

What are the key properties of Sevoflurane?

Sevoflurane has a molecular weight of 200.05 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for Sevoflurane is sourced from PubChem (CID 5206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 5206 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 2439 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.