3,3,3-Trifluoropropylamine hydrochloride

C₃H₇ClF₃NCAS 2968-33-4149.54 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₃H₇ClF₃N
Molar mass: 149.54 g/mol
Exact mass: 149.0219 Da
Melting point: 222–222.5 °C
logP: 1.32Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

2968-33-4

SMILES

Cl.NCCC(F)(F)F

InChIKey

IGOPOYHPIKTQSS-UHFFFAOYSA-N

InChI

InChI=1S/C3H6F3N.ClH/c4-3(5,6)1-2-7;/h1-2,7H2;1H

Weigh it out

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

Names and synonyms

5 names

1-Propanamine, 3,3,3-trifluoro-, hydrochloride (1:1)
Propylamine, 3,3,3-trifluoro-, hydrochloride
1-Propanamine, 3,3,3-trifluoro-, hydrochloride
3,3,3-Trifluoropropylamine monohydrochloride
3,3,3-Trifluoro-1-propanamine hydrochloride

Work with 3,3,3-Trifluoropropylamine hydrochloride

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

2,2,2-Trifluoroethylamine hydrochloride373-88-652 % similar Ethylenediamine hydrochloride18299-54-244 % similar Ethylenediamine hydrochloride333-18-644 % similar β-Fluoroethylamine hydrochloride460-08-241 % similar 1,3-Diaminopropane dihydrochloride10517-44-940 % similar 2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride1171331-39-739 % similar 1,5-Diaminopentane dihydrochloride1476-39-738 % similar Hexanediamine dihydrochloride6055-52-338 % similar

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

Same formula

(S)-1,1,1-Trifluoroisopropylamine hydrochloride125353-44-8

Elsewhere

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