5-Methoxy-2-(trifluoromethyl)pyridine

C₇H₆F₃NOCAS 216766-13-1177.13 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₇H₆F₃NO
Molar mass: 177.13 g/mol
Exact mass: 177.0401 Da
logP: 2.11Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

216766-13-1

SMILES

COc1ccc(C(F)(F)F)nc1

InChIKey

MRHJZBSCOLVMGA-UHFFFAOYSA-N

InChI

InChI=1S/C7H6F3NO/c1-12-5-2-3-6(11-4-5)7(8,9)10/h2-4H,1H3

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

Names and synonyms

2 names

Pyridine, 5-methoxy-2-(trifluoromethyl)-
5-Methoxy-2-trifluoromethylpyridine

Work with 5-Methoxy-2-(trifluoromethyl)pyridine

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-Amino-5-methoxypyridine10167-97-248 % similar 2-Bromo-5-methoxypyridine105170-27-248 % similar 5-Amino-2-(trifluoromethyl)pyridine106877-33-248 % similar 6-(Trifluoromethyl)-3-pyridinol216766-12-048 % similar (5-Methoxypyridin-2-yl)methanol127978-70-544 % similar 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-944 % similar 4-Fluoro-3-(trifluoromethyl)anisole127271-65-243 % similar 1-Methoxy-4-(trifluoromethoxy)benzene710-18-942 % similar

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

Same formula

2-Methoxy-3-(trifluoromethyl)pyridine121643-44-5 3-(Trifluoromethoxy)aniline1535-73-5 2-Trifluoromethoxyaniline1535-75-7 2-Methoxy-5-(trifluoromethyl)pyridine175277-45-9 2-Amino-5-(trifluoromethyl)phenol454-82-0 4-(Trifluoromethoxy)aniline461-82-5

Elsewhere

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