2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane

C8H8F6O4 — CID 14401462

IUPAC2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane
SMILESFC(F)(F)C1(C2(C(F)(F)F)OCCO2)OCCO1
InChIInChI=1S/C8H8F6O4/c9-7(10,11)5(15-1-2-16-5)6(8(12,13)14)17-3-4-18-6/h1-4H2
InChIKeySTOJEGHTXSBJMY-UHFFFAOYSA-N
MW282.14 g/mol
LogP1.60
Rot. Bonds1

About 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane

2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane (PubChem CID 14401462) has the molecular formula C8H8F6O4 and a molecular weight of 282.14 g/mol. Its IUPAC name is 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane.

Molecular Properties

Compound Name2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane
PubChem CID14401462
Molecular FormulaC8H8F6O4
Molecular Weight282.14 g/mol
Exact Mass282.03
IUPAC Name2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane
SMILESFC(F)(F)C1(C2(C(F)(F)F)OCCO2)OCCO1
InChIInChI=1S/C8H8F6O4/c9-7(10,11)5(15-1-2-16-5)6(8(12,13)14)17-3-4-18-6/h1-4H2
InChIKeySTOJEGHTXSBJMY-UHFFFAOYSA-N
XLogP1.60
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.14
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane?
The IUPAC name of 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane (CID 14401462) is 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane.
What is the SMILES notation for 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane?
The canonical SMILES for 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane is FC(F)(F)C1(C2(C(F)(F)F)OCCO2)OCCO1.
What is the InChIKey of 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane?
The InChIKey is STOJEGHTXSBJMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F6O4/c9-7(10,11)5(15-1-2-16-5)6(8(12,13)14)17-3-4-18-6/h1-4H2.
What are the key properties of 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane?
2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane has a molecular weight of 282.14 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-2-[2-(trifluoromethyl)-1,3-dioxolan-2-yl]-1,3-dioxolane is sourced from PubChem (CID 14401462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).