1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane

C8H12F6O3 — CID 87282326

IUPAC1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane
SMILESFC(F)(F)COCCOCCOCC(F)(F)F
InChIInChI=1S/C8H12F6O3/c9-7(10,11)5-16-3-1-15-2-4-17-6-8(12,13)14/h1-6H2
InChIKeyUHIKTEOLOIVDKF-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.16
Rot. Bonds8

About 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane

1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane (PubChem CID 87282326) has the molecular formula C8H12F6O3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane.

Molecular Properties

Compound Name1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane
PubChem CID87282326
Molecular FormulaC8H12F6O3
Molecular Weight270.17 g/mol
Exact Mass270.07
IUPAC Name1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane
SMILESFC(F)(F)COCCOCCOCC(F)(F)F
InChIInChI=1S/C8H12F6O3/c9-7(10,11)5-16-3-1-15-2-4-17-6-8(12,13)14/h1-6H2
InChIKeyUHIKTEOLOIVDKF-UHFFFAOYSA-N
XLogP2.16
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,2,2-trifluoroethoxy)ethyl hypofluorite
CID 89475011
1,3-bis(2,2,2-trifluoroethoxy)propane
CID 57255720
2-[2-[2-[2-[2-[2-[2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 21097608
2,2-difluoro-1-[2-(2,2,2-trifluoroethoxy)ethoxy]propane
CID 175613997
2-(2,2,2-trifluoroethoxy)ethanamine
CID 2060297
2-(2,2,2-trifluoroethoxy)ethanolate
CID 59863337
2-(2,2,2-trifluoroethoxy)ethanethiol
CID 61490314
3-methyl-1-[2-(2,2,2-trifluoroethoxy)ethoxy]butane
CID 171600515
2-[2-(2-azidoethoxy)ethoxy]-1,1,1-trifluoroethane
CID 102514805
2,2-difluoro-3-[2-(2,2,2-trifluoroethoxy)ethoxy]propanoic acid
CID 71623084
ethane;1-(2,2,2-trifluoroethoxy)butane
CID 170752039
lithium 1,5-bis(2,2,2-trifluoroethoxy)pentan-3-olate
CID 175979999

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane?
The IUPAC name of 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane (CID 87282326) is 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane.
What is the SMILES notation for 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane?
The canonical SMILES for 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane is FC(F)(F)COCCOCCOCC(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane?
The InChIKey is UHIKTEOLOIVDKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F6O3/c9-7(10,11)5-16-3-1-15-2-4-17-6-8(12,13)14/h1-6H2.
What are the key properties of 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane?
1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane has a molecular weight of 270.17 g/mol, XLogP of 2.16, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane is sourced from PubChem (CID 87282326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).