chempirical

1,1,2,2-Tetrafluoro-3-(1,1,2,2-tetrafluoroethoxy)propane

C5H4F8OCAS 16627-68-2232.07 g/mol

Open in Covalent MOL file
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Alkyl halideEther

Properties

Molecular formula
C5H4F8O
Molar mass
232.07 g/mol
Exact mass
232.0134 Da
logP
2.76Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
5

Identifiers

CAS number
16627-68-2
SMILES
FC(F)C(F)(F)COC(F)(F)C(F)F
InChIKey
HCBRSIIGBBDDCD-UHFFFAOYSA-N
InChI
InChI=1S/C5H4F8O/c6-2(7)4(10,11)1-14-5(12,13)3(8)9/h2-3H,1H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Propane, 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluoroethoxy)-
  • Ether, 1,1,2,2-tetrafluoroethyl 2,2,3,3-tetrafluoropropyl
  • HFE 458
  • 2,2,3,3-Tetrafluoro-1-(1,1,2,2-tetrafluoroethoxy)propane
  • 1,1,2,2-Tetrafluoroethyl 2,2,3,3-tetrafluoropropyl ether
  • HFE 458pcf-c
  • HFE 458pc-fc

Work with 1,1,2,2-Tetrafluoro-3-(1,1,2,2-tetrafluoroethoxy)propane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1,2,2-Tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane406-78-064 % similar 1-Ethoxy-1,1,2,2-tetrafluoroethane512-51-654 % similar 3-(1,1,2,2-Tetrafluoroethoxy)-1-propene1428-33-747 % similar 2-[(2,2,3,3-Tetrafluoropropoxy)methyl]oxirane19932-26-445 % similar 1-(1,1,2,2-Tetrafluoroethoxy)butane358-37-245 % similar 1-Methoxy-1,1,2,2-tetrafluoroethane425-88-741 % similar 3-Chloro-1,1,2,2-tetrafluoropropane679-85-641 % similar 1,1,2,2-Tetrafluoro-3-iodopropane679-87-841 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,2,3,3,4,4,5,5-Octafluoro-1-pentanol355-80-6

Elsewhere

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