3-Amino-4-(4-methoxyphenoxy)benzotrifluoride

C₁₄H₁₂F₃NO₂CAS 62966-74-9283.25 g/mol

Open in Covalent MOL file

Alkyl halide Ether Primary 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 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

62966-74-9

SMILES

COC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)N

InChIKey

PKPSWDNMWOYYEX-UHFFFAOYSA-N

InChI

InChI=1S/C14H12F3NO2/c1-19-10-3-5-11(6-4-10)20-13-7-2-9(8-12(13)18)14(15,16)17/h2-8H,18H2,1H3

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Names and synonyms

1 names

2-(4-Methoxyphenoxy)-5-(trifluoromethyl)aniline

Work with 3-Amino-4-(4-methoxyphenoxy)benzotrifluoride

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)aniline349-65-571 % similar 2-(4-Chloro-3,5-dimethylphenoxy)-5-(trifluoromethyl)aniline175134-99-361 % similar 1-Methoxy-4-(trifluoromethyl)benzene402-52-859 % similar 4-(4-Methoxyphenoxy)-3-nitrobenzotrifluoride1996-69-659 % similar 3,4-Diaminobenzotrifluoride368-71-850 % similar 4-Methoxy-2-(trifluoromethyl)aniline53903-49-450 % similar 2-Methyl-5-(trifluoromethyl)aniline25449-96-149 % similar 1-Methoxy-3-(trifluoromethyl)benzene454-90-049 % similar

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

Same formula

2-(2-Methoxyphenoxy)-5-(trifluoromethyl)benzenamine175135-08-7

Elsewhere

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