[3-(3,4-Dimethylphenyl)-1-adamantyl]methylamine CAS 400749-85-1

Purity 97%+In StockPharmaceutical Standards
CAS No.400749-85-1
Molecular FormulaC19H27N
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

[3-(3,4-Dimethylphenyl)-1-adamantyl]methylamine CAS 400749-85-1 chemical structure

Description

The occurrence of [3-(3,4-Dimethylphenyl)-1-adamantyl]methylamine is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

[3-(3,4-Dimethylphenyl)-1-adamantyl]methylamine (CAS 400749-85-1), molecular formula C19H27NHCl and molecular weight 305.89 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of [3-(3,4-Dimethylphenyl)-1-adamantyl]methylamine (C19H27NHCl) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC19H27N HCl
Molecular Weight305.89 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms1

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