3-(Trifluoromethoxy)anisole

C₈H₇F₃O₂CAS 142738-94-1192.14 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₈H₇F₃O₂
Molar mass: 192.14 g/mol
Exact mass: 192.0398 Da
logP: 2.59Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

142738-94-1

SMILES

COC1=CC(=CC=C1)OC(F)(F)F

InChIKey

OKSRAPDSZKICKZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H7F3O2/c1-12-6-3-2-4-7(5-6)13-8(9,10)11/h2-5H,1H3

Weigh it out

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

Work with 3-(Trifluoromethoxy)anisole

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

1,3-Dimethoxybenzene151-10-064 % similar 3-(Trifluoromethoxy)fluorobenzene1077-01-660 % similar 3-(Trifluoromethoxy)benzenethiol220239-66-758 % similar 3-(Trifluoromethoxy)aniline1535-73-556 % similar 1-Bromo-3-(trifluoromethoxy)benzene2252-44-056 % similar 1-Methoxy-3-(trifluoromethyl)benzene454-90-056 % similar (Trifluoromethoxy)benzene456-55-354 % similar 3-Chloroanisole2845-89-853 % similar

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

Same formula

4-(Trifluoromethoxy)benzenemethanol1736-74-9 2-(Trifluoromethoxy)benzenemethanol175278-07-6 1-Methoxy-4-(trifluoromethoxy)benzene710-18-9

Elsewhere

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