1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane

C8H12F6O — CID 19087430

IUPAC1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
SMILESCC(C)(OC(C)(C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H12F6O/c1-5(2,7(9,10)11)15-6(3,4)8(12,13)14/h1-4H3
InChIKeyQIPIRPDYZPOPEG-UHFFFAOYSA-N
MW238.17 g/mol
LogP3.68
Rot. Bonds2

About 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane

1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane (PubChem CID 19087430) has the molecular formula C8H12F6O and a molecular weight of 238.17 g/mol. Its IUPAC name is 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane.

Molecular Properties

Compound Name1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
PubChem CID19087430
Molecular FormulaC8H12F6O
Molecular Weight238.17 g/mol
Exact Mass238.08
IUPAC Name1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
SMILESCC(C)(OC(C)(C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H12F6O/c1-5(2,7(9,10)11)15-6(3,4)8(12,13)14/h1-4H3
InChIKeyQIPIRPDYZPOPEG-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.17
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Fluoromethyl-1,1,1,3,3,3-hexafluoro-2-propyl ether
CID 22178431
1,1,1,3,3,3-Hexafluoro-2-methyl-2-propoxypropane
CID 138604548
2,2,3-Trifluoro-3-(2,3,3-trifluorobutan-2-yloxy)butane
CID 12951110
2-Methyl-2-(1,1,2,2-tetrafluoroethoxy)propane
CID 2782467
2-Methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane
CID 10130317
2-(1,1,2,2,3,3,3-Heptafluoropropoxy)-2-methylpropane
CID 10198680
1,1,1,2-Tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane
CID 18913766
1,1,1,3,3,3-Hexafluoro-2-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)oxy-2-methylpropane
CID 19066587
1,1,1,2,3,4-Hexafluoro-3-(1,1,1,2,3,4-hexafluoropentan-3-yloxy)pentane
CID 20352484
2-Methyl-2-[1,1,2,2-tetrafluoro-2-[(2-methylpropan-2-yl)oxy]ethoxy]propane
CID 20760257
2-Methyl-2-(1,1,2-trifluoroethoxy)propane
CID 21049803
1,1,1,2,2,3-Hexafluoro-3-(2,3,3,4,4,4-hexafluorobutan-2-yloxy)butane
CID 21083129

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane?
The IUPAC name of 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane (CID 19087430) is 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane.
What is the SMILES notation for 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane?
The canonical SMILES for 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane is CC(C)(OC(C)(C)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane?
The InChIKey is QIPIRPDYZPOPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F6O/c1-5(2,7(9,10)11)15-6(3,4)8(12,13)14/h1-4H3.
What are the key properties of 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane?
1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane has a molecular weight of 238.17 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane is sourced from PubChem (CID 19087430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).