2-Fluoro-3-trifluoromethoxy aniline

C₇H₅F₄NOCAS 116369-23-4195.12 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ether Primary amine

Properties

Molecular formula: C₇H₅F₄NO
Molar mass: 195.12 g/mol
Exact mass: 195.0307 Da
logP: 2.31Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

116369-23-4

SMILES

C1=CC(=C(C=C1OC(F)(F)F)N)F

InChIKey

HQUWXEXDIIWBBY-UHFFFAOYSA-N

InChI

InChI=1S/C7H5F4NO/c8-5-2-1-4(3-6(5)12)13-7(9,10)11/h1-3H,12H2

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

Names and synonyms

1 names

2-Fluoro-5-(trifluoromethoxy)aniline

Work with 2-Fluoro-3-trifluoromethoxy aniline

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-Bromo-4-trifluoromethoxyaniline175278-17-857 % similar 2-Fluoro-5-(trifluoromethoxy)benzaldehyde886497-81-054 % similar 4-(Trifluoromethoxy)aniline461-82-550 % similar 3-(Trifluoromethoxy)aniline1535-73-549 % similar 3-(Trifluoromethoxy)fluorobenzene1077-01-647 % similar 1-Fluoro-4-(trifluoromethoxy)benzene352-67-047 % similar 2,5-Difluoroaniline367-30-647 % similar 4-Fluoro-1,3-phenylenediamine6264-67-147 % similar

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

Same formula

3-Fluoro-4-(trifluoromethoxy)aniline1017779-69-9

Elsewhere

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