(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol

C6H6F6O3 — CID 88560955

IUPAC(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol
SMILESCOC1(F)C(F)(F)OC(F)(F)C1(F)CO
InChIInChI=1S/C6H6F6O3/c1-14-4(8)3(7,2-13)5(9,10)15-6(4,11)12/h13H,2H2,1H3
InChIKeyREXGWNGXPMKCDL-UHFFFAOYSA-N
MW240.10 g/mol
LogP1.22
Rot. Bonds2

About (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol

(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol (PubChem CID 88560955) has the molecular formula C6H6F6O3 and a molecular weight of 240.10 g/mol. Its IUPAC name is (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol.

Molecular Properties

Compound Name(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol
PubChem CID88560955
Molecular FormulaC6H6F6O3
Molecular Weight240.10 g/mol
Exact Mass240.02
IUPAC Name(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol
SMILESCOC1(F)C(F)(F)OC(F)(F)C1(F)CO
InChIInChI=1S/C6H6F6O3/c1-14-4(8)3(7,2-13)5(9,10)15-6(4,11)12/h13H,2H2,1H3
InChIKeyREXGWNGXPMKCDL-UHFFFAOYSA-N
XLogP1.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.10
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol?
The IUPAC name of (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol (CID 88560955) is (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol.
What is the SMILES notation for (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol?
The canonical SMILES for (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol is COC1(F)C(F)(F)OC(F)(F)C1(F)CO.
What is the InChIKey of (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol?
The InChIKey is REXGWNGXPMKCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F6O3/c1-14-4(8)3(7,2-13)5(9,10)15-6(4,11)12/h13H,2H2,1H3.
What are the key properties of (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol?
(2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol has a molecular weight of 240.10 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,3,4,5,5-hexafluoro-4-methoxyoxolan-3-yl)methanol is sourced from PubChem (CID 88560955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).