2.3-Difluoro 4-trifluoromethoxyaniline

C₇H₄F₅NCAS 123950-46-9197.11 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₇H₄F₅N
Molar mass: 197.11 g/mol
Exact mass: 197.0264 Da
logP: 2.57Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

123950-46-9

SMILES

C1=CC(=C(C(=C1C(F)(F)F)F)F)N

InChIKey

RRTVKWPCWJVMGM-UHFFFAOYSA-N

InChI

InChI=1S/C7H4F5N/c8-5-3(7(10,11)12)1-2-4(13)6(5)9/h1-2H,13H2

Weigh it out

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

Names and synonyms

1 names

4-Amino-2,3-difluorobenzotrifluoride

Work with 2.3-Difluoro 4-trifluoromethoxyaniline

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-Fluoro-3-(trifluoromethyl)aniline123973-25-168 % similar 4-Fluoro-2-(trifluoromethyl)aniline393-39-552 % similar 2,3,4-Trifluoroaniline3862-73-550 % similar 2-(Trifluoromethyl)aniline88-17-548 % similar 4-Bromo-2,3-difluorobenzenamine112279-72-847 % similar 4-Amino-2,3-difluorophenol163733-99-147 % similar 4-Bromo-2-(trifluoromethyl)aniline445-02-345 % similar 2-Trifluoromethyl-4-chloroaniline445-03-445 % similar

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

Same formula

4-Amino-2,5-difluorobenzotrifluoride114973-22-7 3,5-Difluoro-4-(trifluoromethyl)benzenamine123950-44-7

Elsewhere

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