2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane

C11H15F7O2 — CID 59010348

IUPAC2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane
SMILESCCOC1(C(F)(C(F)(F)F)C(F)(F)F)CC(C)C(C)O1
InChIInChI=1S/C11H15F7O2/c1-4-19-8(5-6(2)7(3)20-8)9(12,10(13,14)15)11(16,17)18/h6-7H,4-5H2,1-3H3
InChIKeyIOEPSZIQDHKATP-UHFFFAOYSA-N
MW312.23 g/mol
LogP4.00
Rot. Bonds3

About 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane

2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane (PubChem CID 59010348) has the molecular formula C11H15F7O2 and a molecular weight of 312.23 g/mol. Its IUPAC name is 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane.

Molecular Properties

Compound Name2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane
PubChem CID59010348
Molecular FormulaC11H15F7O2
Molecular Weight312.23 g/mol
Exact Mass312.10
IUPAC Name2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane
SMILESCCOC1(C(F)(C(F)(F)F)C(F)(F)F)CC(C)C(C)O1
InChIInChI=1S/C11H15F7O2/c1-4-19-8(5-6(2)7(3)20-8)9(12,10(13,14)15)11(16,17)18/h6-7H,4-5H2,1-3H3
InChIKeyIOEPSZIQDHKATP-UHFFFAOYSA-N
XLogP4.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.23
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane?
The IUPAC name of 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane (CID 59010348) is 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane.
What is the SMILES notation for 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane?
The canonical SMILES for 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane is CCOC1(C(F)(C(F)(F)F)C(F)(F)F)CC(C)C(C)O1.
What is the InChIKey of 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane?
The InChIKey is IOEPSZIQDHKATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F7O2/c1-4-19-8(5-6(2)7(3)20-8)9(12,10(13,14)15)11(16,17)18/h6-7H,4-5H2,1-3H3.
What are the key properties of 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane?
2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane has a molecular weight of 312.23 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4,5-dimethyloxolane is sourced from PubChem (CID 59010348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).