N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine-d3 Hydrochloride CAS 1794810-75-5

Purity 97%+In StockPharmaceutical Standards
CAS No.1794810-75-5
Molecular Formula-
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine-d3 Hydrochloride CAS 1794810-75-5 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 246.75 g/mol gives N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine-d3 Hydrochloride distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine-d3 Hydrochloride (CAS 1794810-75-5) is a high-purity analytical reference standard with the molecular formula C12H14D3NO2HCl and a molecular weight of 246.75 g/mol.

N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine-d3 Hydrochloride (C12H14D3NO2HCl) contains deuterium isotope labeling, a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC12H14D3NO2 HCl
Molecular Weight246.75 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)5.5
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1994
Halogen ContentCl-containing
Nitrogen Atoms1

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