chempirical

2-(2-Methoxyphenoxy)-5-(trifluoromethyl)benzenamine

C14H12F3NO2CAS 175135-08-7283.25 g/mol

Open in Covalent MOL file
OOFFFNH2
Alkyl halideEtherPrimary amine

Properties

Molecular formula
C14H12F3NO2
Molar mass
283.25 g/mol
Exact mass
283.0820 Da
logP
4.09Crippen estimate
Polar surface area
44.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
175135-08-7
SMILES
COc1ccccc1Oc1ccc(C(F)(F)F)cc1N
InChIKey
PYNDGRAUAXTKAO-UHFFFAOYSA-N
InChI
InChI=1S/C14H12F3NO2/c1-19-12-4-2-3-5-13(12)20-11-7-6-9(8-10(11)18)14(15,16)17/h2-8H,18H2,1H3

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Names and synonyms

2 names
  • Benzenamine, 2-(2-methoxyphenoxy)-5-(trifluoromethyl)-
  • 2-(2-Methoxyphenoxy)-5-(trifluoromethyl)aniline

Work with 2-(2-Methoxyphenoxy)-5-(trifluoromethyl)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-Methoxy-5-(trifluoromethyl)aniline349-65-574 % similar Methyl 2-amino-4-(trifluoromethyl)benzoate61500-87-646 % similar 4-Methoxy-3-nitrobenzotrifluoride394-25-245 % similar 2-Methoxy-4-(trifluoromethyl)benzaldehyde132927-09-444 % similar 2-Amino-4-(trifluoromethyl)benzonitrile1483-54-144 % similar 2-Iodo-5-(trifluoromethyl)aniline105202-02-644 % similar 2-Chloro-5-(trifluoromethyl)aniline121-50-644 % similar 2-Bromo-5-trifluoromethylaniline454-79-544 % similar

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

Elsewhere

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