4-Amino-8-(trifluoromethyl)quinoline

C₁₀H₇F₃N₂CAS 243977-15-3212.18 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₁₀H₇F₃N₂
Molar mass: 212.18 g/mol
Exact mass: 212.0561 Da
logP: 2.84Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed20% of notifiers
H312 Harmful in contact with skin20% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled20% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

243977-15-3

SMILES

C1=CC2=C(C=CN=C2C(=C1)C(F)(F)F)N

InChIKey

JTMLOHYYNHRKTF-UHFFFAOYSA-N

InChI

InChI=1S/C10H7F3N2/c11-10(12,13)7-3-1-2-6-8(14)4-5-15-9(6)7/h1-5H,(H2,14,15)

Weigh it out

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

Names and synonyms

1 names

8-(Trifluoromethyl)quinolin-4-amine

Work with 4-Amino-8-(trifluoromethyl)quinoline

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

4-Chloro-8-(trifluoromethyl)quinoline23779-97-764 % similar 8-(Trifluoromethyl)-4-quinolinol23779-96-662 % similar 2-Methyl-3-(trifluoromethyl)aniline54396-44-047 % similar 2-(Trifluoromethyl)aniline88-17-547 % similar 2-Fluoro-3-(trifluoromethyl)aniline123973-25-146 % similar 2-Amino-3-(trifluoromethyl)pyridine183610-70-046 % similar 2-Chloro-3-(trifluoromethyl)aniline62476-58-846 % similar 2-Bromo-3-(trifluoromethyl)benzenamine58458-10-945 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Amino-7-(trifluoromethyl)quinoline243666-11-7 TRIM25371-96-4 1-(3-Trifluoromethylphenyl)imidazole25371-97-5 1-(4-Trifluoromethylphenyl)imidazole25371-98-6

Elsewhere

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