chempirical

4-Amino-7-(trifluoromethyl)quinoline

C10H7F3N2CAS 243666-11-7212.18 g/mol

Open in Covalent MOL file
NFFFNH2
Alkyl halidePrimary 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 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
243666-11-7
SMILES
C1=CC2=C(C=CN=C2C=C1C(F)(F)F)N
InChIKey
QZOOIAOULGJTJI-UHFFFAOYSA-N
InChI
InChI=1S/C10H7F3N2/c11-10(12,13)6-1-2-7-8(14)3-4-15-9(7)5-6/h1-5H,(H2,14,15)

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

Work with 4-Amino-7-(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-7-(trifluoromethyl)quinoline346-55-462 % similar 4-Amino-7-chloroquinoline1198-40-954 % similar 2-Amino-4-(trifluoromethyl)pyridine106447-97-650 % similar 7-(Trifluoromethyl)quinoline325-14-450 % similar 3,4-Diaminobenzotrifluoride368-71-850 % similar 2,5-Bis(trifluoromethyl)aniline328-93-847 % similar 2,4-Bis(trifluoromethyl)aniline367-71-547 % similar 4,4'-Bis(trifluoromethyl)-2,2'-bipyridine142946-79-046 % similar

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

Same formula

4-Amino-8-(trifluoromethyl)quinoline243977-15-3 TRIM25371-96-4 1-(3-Trifluoromethylphenyl)imidazole25371-97-5 1-(4-Trifluoromethylphenyl)imidazole25371-98-6

Elsewhere

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