4-Amino-2-trifluoromethylpyridine

C6H5F3N2CAS 147149-98-2162.12 g/mol

Open in Covalent MOL file
NH2NFFF
Alkyl halidePrimary amine

Properties

Molecular formula
C6H5F3N2
Molar mass
162.12 g/mol
Exact mass
162.0405 Da
logP
1.68Crippen estimate
Polar surface area
38.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, P501

Identifiers

CAS number
147149-98-2
SMILES
C1=CN=C(C=C1N)C(F)(F)F
InChIKey
LYNBZRJTRHTSKI-UHFFFAOYSA-N
InChI
InChI=1S/C6H5F3N2/c7-6(8,9)5-3-4(10)1-2-11-5/h1-3H,(H2,10,11)

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Names and synonyms

1 names
  • 2-(Trifluoromethyl)pyridin-4-amine

Work with 4-Amino-2-trifluoromethylpyridine

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-Trifluoromethyl-4-chloropyridine131748-14-655 % similar 4-Iodo-2-(trifluoromethyl)pyridine590371-73-655 % similar 2-Amino-4-(trifluoromethyl)pyrimidine16075-42-650 % similar 4,4'-Diamino-2,2'-bipyridine18511-69-850 % similar 4-Amino-2-fluoropyridine18614-51-250 % similar 2-Chloro-6-(trifluoromethyl)pyridin-4-amine34486-22-147 % similar 6-(Trifluoromethyl)pyrimidin-4-amine672-41-347 % similar 2-(Trifluoromethyl)pyridine368-48-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-4-(trifluoromethyl)pyridine106447-97-6 5-Amino-2-(trifluoromethyl)pyridine106877-33-2 5-(Trifluoromethyl)pyridin-3-amine112110-07-3 3-Amino-4-(trifluoromethyl)pyridine175204-80-5 2-Amino-3-(trifluoromethyl)pyridine183610-70-0 2-Amino-6-(trifluoromethyl)pyridine34486-24-3 4-Amino-3-(trifluoromethyl)pyridine387824-61-5 5-(Trifluoromethyl)pyridin-2-amine74784-70-6

Elsewhere

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