2,6-Dichloro-4-(trifluoromethoxy)benzenamine

C₇H₄Cl₂F₃NOCAS 99479-66-0246.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ether Primary amine

Properties

Molecular formula: C₇H₄Cl₂F₃NO
Molar mass: 246.01 g/mol
Exact mass: 244.9622 Da
logP: 3.47Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

99479-66-0

SMILES

Nc1c(Cl)cc(OC(F)(F)F)cc1Cl

InChIKey

FKISQWQHZULEEG-UHFFFAOYSA-N

InChI

InChI=1S/C7H4Cl2F3NO/c8-4-1-3(14-7(10,11)12)2-5(9)6(4)13/h1-2H,13H2

Weigh it out

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

Names and synonyms

3 names

Benzenamine, 2,6-dichloro-4-(trifluoromethoxy)-
2,6-Dichloro-4-trifluoromethoxyaniline
[2,6-Dichloro-4-(trifluoromethoxy)phenyl]amine

Work with 2,6-Dichloro-4-(trifluoromethoxy)benzenamine

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

2,6-Dibromo-4-trifluoromethoxyaniline88149-49-956 % similar 2,6-Dichloro-4-trifluoromethylaniline24279-39-852 % similar 3-(Trifluoromethoxy)aniline1535-73-547 % similar 2,6-Dichloro-4-fluorobenzenamine344-19-447 % similar 2,6-Dichloro-1,4-benzenediamine609-20-145 % similar 2,4,6-Trichloroaniline634-93-545 % similar 1-Chloro-4-(trifluoromethoxy)benzene461-81-444 % similar 4-(Trifluoromethoxy)aniline461-82-544 % similar

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

Elsewhere

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