1,1-Dimethylethyl 6,7-dibromo-1,4-dihydronaphthalen-1,4-imine-9-carboxylate CAS 949593-08-2

Purity 97%+In StockPharmaceutical Standards
CAS No.949593-08-2
Molecular FormulaC15H15Br2NO2
Molecular Weight401.09 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1,1-Dimethylethyl 6,7-dibromo-1,4-dihydronaphthalen-1,4-imine-9-carboxylate CAS 949593-08-2 chemical structure

Description

The occurrence of 1,1-Dimethylethyl 6,7-dibromo-1,4-dihydronaphthalen-1,4-imine-9-carboxylate is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1,1-Dimethylethyl 6,7-dibromo-1,4-dihydronaphthalen-1,4-imine-9-carboxylate (CAS 949593-08-2), molecular formula C15H15Br2NO2 and molecular weight 401.09 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine substitution, 1,1-Dimethylethyl 6,7-dibromo-1,4-dihydronaphthalen-1,4-imine-9-carboxylate is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 401.09 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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 FormulaC15H15Br2NO2
Molecular Weight401.09 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, protect from light
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)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentBr-containing
Nitrogen Atoms1

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