2-(Trifluoromethyl)benzene-1,4-diamine

C₇H₇F₃N₂CAS 364-13-6176.14 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₇H₇F₃N₂
Molar mass: 176.14 g/mol
Exact mass: 176.0561 Da
logP: 1.87Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

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

364-13-6

SMILES

C1=CC(=C(C=C1N)C(F)(F)F)N

InChIKey

ZQQOGBKIFPCFMJ-UHFFFAOYSA-N

InChI

InChI=1S/C7H7F3N2/c8-7(9,10)5-3-4(11)1-2-6(5)12/h1-3H,11-12H2

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Names and synonyms

1 names

2-(Trifluoromethyl)-1,4-phenyldiamine

Work with 2-(Trifluoromethyl)benzene-1,4-diamine

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

2,2'-Bis(trifluoromethyl)benzidine341-58-267 % similar 3,3'-Bis(trifluoromethyl)benzidine346-88-367 % similar 2,4-Bis(trifluoromethyl)aniline367-71-564 % similar 4-Fluoro-3-(trifluoromethyl)aniline2357-47-362 % similar 4-Fluoro-2-(trifluoromethyl)aniline393-39-562 % similar 4-Chloro-3-(trifluoromethyl)aniline320-51-460 % similar 4,4'-Oxybis[3-(trifluoromethyl)aniline]344-48-960 % similar 4-Bromo-3-(trifluoromethyl)aniline393-36-260 % similar

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

Same formula

5-(Trifluoromethyl)-2-pyridinemethanamine164341-39-3 [2-(Trifluoromethyl)phenyl]hydrazine365-34-4 3,5-Diaminobenzotrifluoride368-53-6 3,4-Diaminobenzotrifluoride368-71-8 [3-(Trifluoromethyl)phenyl]hydrazine368-78-5 4-Trifluoromethylphenylhydrazine368-90-1 2-Methyl-6-(trifluoromethyl)-3-pyridinamine383907-17-3 5-(Aminomethyl)-2-(trifluoromethyl)pyridine387350-39-2

Elsewhere

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