2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane

C7H8F8O — CID 58114509

IUPAC2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane
SMILESCCOC(F)(C(F)CC(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F8O/c1-2-16-6(12,7(13,14)15)4(8)3-5(9,10)11/h4H,2-3H2,1H3
InChIKeyMNENOWDPGSHHNT-UHFFFAOYSA-N
MW260.12 g/mol
LogP3.54
Rot. Bonds4

About 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane

2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane (PubChem CID 58114509) has the molecular formula C7H8F8O and a molecular weight of 260.12 g/mol. Its IUPAC name is 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane.

Molecular Properties

Compound Name2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane
PubChem CID58114509
Molecular FormulaC7H8F8O
Molecular Weight260.12 g/mol
Exact Mass260.04
IUPAC Name2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane
SMILESCCOC(F)(C(F)CC(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F8O/c1-2-16-6(12,7(13,14)15)4(8)3-5(9,10)11/h4H,2-3H2,1H3
InChIKeyMNENOWDPGSHHNT-UHFFFAOYSA-N
XLogP3.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.12
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane?
The IUPAC name of 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane (CID 58114509) is 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane.
What is the SMILES notation for 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane?
The canonical SMILES for 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane is CCOC(F)(C(F)CC(F)(F)F)C(F)(F)F.
What is the InChIKey of 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane?
The InChIKey is MNENOWDPGSHHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F8O/c1-2-16-6(12,7(13,14)15)4(8)3-5(9,10)11/h4H,2-3H2,1H3.
What are the key properties of 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane?
2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane has a molecular weight of 260.12 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,1,1,2,3,5,5,5-octafluoropentane is sourced from PubChem (CID 58114509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).