2-Amino-5-(trifluoromethyl)pyrazine

C₅H₄F₃N₃CAS 69816-38-2163.10 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₅H₄F₃N₃
Molar mass: 163.10 g/mol
Exact mass: 163.0357 Da
logP: 1.08Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled90.3% of notifiers
H302 Harmful if swallowed96.8% of notifiers
H312 Harmful in contact with skin93.5% of notifiers
H332 Harmful if inhaled93.5% of notifiers

Aggregated from 31 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number

69816-38-2

SMILES

C1=C(N=CC(=N1)N)C(F)(F)F

InChIKey

ILDRNIDSVAZBMZ-UHFFFAOYSA-N

InChI

InChI=1S/C5H4F3N3/c6-5(7,8)3-1-11-4(9)2-10-3/h1-2H,(H2,9,11)

Weigh it out

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

Names and synonyms

1 names

5-(Trifluoromethyl)pyrazin-2-amine

Work with 2-Amino-5-(trifluoromethyl)pyrazine

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-Chloro-5-(trifluoromethyl)pyrazine799557-87-252 % similar 5-Amino-2-(trifluoromethyl)pyridine106877-33-250 % similar 5-(Trifluoromethyl)pyridin-2-amine74784-70-650 % similar 2-Amino-6-(trifluoromethyl)pyridine34486-24-345 % similar 5-Chloro-2-pyrazinamine33332-29-541 % similar 5-Methyl-2-pyrazinamine5521-58-441 % similar 2-Amino-5-bromopyrazine59489-71-341 % similar 5-(Aminomethyl)-2-(trifluoromethyl)pyridine387350-39-241 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-4-(trifluoromethyl)pyrimidine16075-42-6 6-(Trifluoromethyl)pyrimidin-4-amine672-41-3

Elsewhere

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