1,4-Bis(2,2,2-trifluoroethoxy)benzene

C₁₀H₈F₆O₂CAS 66300-61-6274.16 g/mol

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Alkyl halide Ether

Properties

Molecular formula: C₁₀H₈F₆O₂
Molar mass: 274.16 g/mol
Exact mass: 274.0428 Da
Melting point: 70 °C
logP: 3.57Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

66300-61-6

SMILES

FC(F)(F)COc1ccc(OCC(F)(F)F)cc1

InChIKey

ZHUBFESHPMGIDZ-UHFFFAOYSA-N

InChI

InChI=1S/C10H8F6O2/c11-9(12,13)5-17-7-1-2-8(4-3-7)18-6-10(14,15)16/h1-4H,5-6H2

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Names and synonyms

1 names

Benzene, 1,4-bis(2,2,2-trifluoroethoxy)-

Work with 1,4-Bis(2,2,2-trifluoroethoxy)benzene

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

2,5-Bis(2,2,2-trifluoroethoxy)benzoic acid35480-52-547 % similar 4-[2,5-Bis(2,2,2-trifluoroethoxy)phenyl]-1,2,3-thiadiazole175205-47-744 % similar 1,1′-Oxybis[2,2,2-trifluoroethane]333-36-843 % similar 2-Fluoro-6-(2,2,2-trifluoroethoxy)benzonitrile119584-74-638 % similar 2-(2,2,2-Trifluoroethoxy)-3-pyridinecarbonitrile175277-89-138 % similar 1,4-Diethoxybenzene122-95-238 % similar Tris(2,2,2-trifluoroethyl) borate659-18-738 % similar 2-Ethoxy-6-(2,2,2-trifluoroethoxy)benzonitrile175204-04-337 % similar

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

Elsewhere

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