chempirical

4,4'-Dimethyloctafluorobiphenyl

C14H6F8CAS 26475-18-3326.19 g/mol

Open in Covalent MOL file
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Aryl halide

Properties

Molecular formula
C14H6F8
Molar mass
326.19 g/mol
Exact mass
326.0342 Da
logP
5.08Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
26475-18-3
SMILES
CC1=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)C)F)F)F)F
InChIKey
IMAVLXWSVGAOCU-UHFFFAOYSA-N
InChI
InChI=1S/C14H6F8/c1-3-7(15)11(19)5(12(20)8(3)16)6-13(21)9(17)4(2)10(18)14(6)22/h1-2H3

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Work with 4,4'-Dimethyloctafluorobiphenyl

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

2,3,5,6-Tetrafluoro-P-xylene703-87-779 % similar 2,3,4,5,6-Pentafluorotoluene771-56-273 % similar Decafluorobiphenyl434-90-253 % similar 4-Methyl-2,3,5,6-tetrafluorobenzyl alcohol79538-03-748 % similar 1,2,4,5-Tetrafluoro-3-methylbenzene5230-78-448 % similar 2,3,5,6-Tetrafluoro-4-methylbenzoic acid652-32-442 % similar 4,4'-Dibromo-2,2',3,3',5,5',6,6'-octafluoro-1,1'-biphenyl10386-84-242 % similar 4,4'-Dimethoxyoctafluorobiphenyl2200-71-741 % similar

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

Elsewhere

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