(2S,4R)-4-(3-bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride CAS 1049734-10-2

Purity 97%+In StockPharmaceutical Standards
CAS No.1049734-10-2
Molecular FormulaC12H14BrNO2
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

(2S,4R)-4-(3-bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride CAS 1049734-10-2 chemical structure

Description

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

(2S,4R)-4-(3-bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride (CAS 1049734-10-2), molecular formula C12H14BrNO2HCl and molecular weight 320.61 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, (2S,4R)-4-(3-bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride (C12H14BrNO2HCl) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 320.61 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC12H14BrNO2 HCl
Molecular Weight320.61 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, 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)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentCl/Br-containing
Nitrogen Atoms1

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