2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane

C11H23FO2 — CID 58862902

IUPAC2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane
SMILESCCOC(C)(C)C(C)(C)OC(C)(C)F
InChIInChI=1S/C11H23FO2/c1-8-13-9(2,3)10(4,5)14-11(6,7)12/h8H2,1-7H3
InChIKeyKTIGENRUESOTET-UHFFFAOYSA-N
MW206.30 g/mol
LogP3.30
Rot. Bonds5

About 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane

2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane (PubChem CID 58862902) has the molecular formula C11H23FO2 and a molecular weight of 206.30 g/mol. Its IUPAC name is 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane.

Molecular Properties

Compound Name2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane
PubChem CID58862902
Molecular FormulaC11H23FO2
Molecular Weight206.30 g/mol
Exact Mass206.17
IUPAC Name2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane
SMILESCCOC(C)(C)C(C)(C)OC(C)(C)F
InChIInChI=1S/C11H23FO2/c1-8-13-9(2,3)10(4,5)14-11(6,7)12/h8H2,1-7H3
InChIKeyKTIGENRUESOTET-UHFFFAOYSA-N
XLogP3.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.30
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane?
The IUPAC name of 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane (CID 58862902) is 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane.
What is the SMILES notation for 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane?
The canonical SMILES for 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane is CCOC(C)(C)C(C)(C)OC(C)(C)F.
What is the InChIKey of 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane?
The InChIKey is KTIGENRUESOTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FO2/c1-8-13-9(2,3)10(4,5)14-11(6,7)12/h8H2,1-7H3.
What are the key properties of 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane?
2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane has a molecular weight of 206.30 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(2-fluoropropan-2-yloxy)-2,3-dimethylbutane is sourced from PubChem (CID 58862902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).