[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol

C6H6F6O3 — CID 58017934

IUPAC[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol
SMILESOCC1(F)C(F)(F)OC(F)(F)C1(F)CO
InChIInChI=1S/C6H6F6O3/c7-3(1-13)4(8,2-14)6(11,12)15-5(3,9)10/h13-14H,1-2H2
InChIKeyRFQZDNYLELACCD-UHFFFAOYSA-N
MW240.10 g/mol
LogP0.60
Rot. Bonds2

About [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol

[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol (PubChem CID 58017934) 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-(hydroxymethyl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol
PubChem CID58017934
Molecular FormulaC6H6F6O3
Molecular Weight240.10 g/mol
Exact Mass240.02
IUPAC Name[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol
SMILESOCC1(F)C(F)(F)OC(F)(F)C1(F)CO
InChIInChI=1S/C6H6F6O3/c7-3(1-13)4(8,2-14)6(11,12)15-5(3,9)10/h13-14H,1-2H2
InChIKeyRFQZDNYLELACCD-UHFFFAOYSA-N
XLogP0.60
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.10
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4,4-Difluorooxolan-3-yl)methanol
CID 105427956
(2,2,3,4,5,5-Hexafluoro-4-methoxyoxolan-3-yl)methanol
CID 88560955
[3-(Difluoromethyl)tetrahydrofuran-3-yl]methanol
CID 163297243
[3-(Trifluoromethyl)oxolan-3-yl]methanol
CID 175998389
[4-(Trifluoromethyl)oxolan-3-yl]methanol
CID 165598897

Frequently Asked Questions

What is the IUPAC name of [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol?
The IUPAC name of [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol (CID 58017934) is [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol.
What is the SMILES notation for [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol?
The canonical SMILES for [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol is OCC1(F)C(F)(F)OC(F)(F)C1(F)CO.
What is the InChIKey of [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol?
The InChIKey is RFQZDNYLELACCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F6O3/c7-3(1-13)4(8,2-14)6(11,12)15-5(3,9)10/h13-14H,1-2H2.
What are the key properties of [2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol?
[2,2,3,4,5,5-hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol has a molecular weight of 240.10 g/mol, XLogP of 0.60, 2 rotatable bonds, 2 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-(hydroxymethyl)oxolan-3-yl]methanol is sourced from PubChem (CID 58017934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).