1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol

C5H2F10O2 — CID 175282352

IUPAC1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol
SMILESOC(OC(F)(F)C(F)F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C5H2F10O2/c6-1(7)2(8,9)17-3(16,4(10,11)12)5(13,14)15/h1,16H
InChIKeyGUUXPRONAOOSNU-UHFFFAOYSA-N
MW284.05 g/mol
LogP2.67
Rot. Bonds3

About 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol

1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol (PubChem CID 175282352) has the molecular formula C5H2F10O2 and a molecular weight of 284.05 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol.

Molecular Properties

Compound Name1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol
PubChem CID175282352
Molecular FormulaC5H2F10O2
Molecular Weight284.05 g/mol
Exact Mass283.99
IUPAC Name1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol
SMILESOC(OC(F)(F)C(F)F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C5H2F10O2/c6-1(7)2(8,9)17-3(16,4(10,11)12)5(13,14)15/h1,16H
InChIKeyGUUXPRONAOOSNU-UHFFFAOYSA-N
XLogP2.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.05
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol?
The IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol (CID 175282352) is 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol.
What is the SMILES notation for 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol?
The canonical SMILES for 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol is OC(OC(F)(F)C(F)F)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol?
The InChIKey is GUUXPRONAOOSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F10O2/c6-1(7)2(8,9)17-3(16,4(10,11)12)5(13,14)15/h1,16H.
What are the key properties of 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol?
1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol has a molecular weight of 284.05 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoroethoxy)propan-2-ol is sourced from PubChem (CID 175282352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).