O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate CAS 2593307-96-9

Purity 97%+In StockPharmaceutical Standards
CAS No.2593307-96-9
Molecular FormulaC21H35IN2O4
Molecular Weight506.42 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate CAS 2593307-96-9 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 506.42 g/mol gives O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate (CAS 2593307-96-9), a certified reference material (molecular formula C21H35IN2O4, MW 506.42 g/mol) for analytical method development and quality control.

Owing to a steroid core, an amide group, a hydroxyl group, an ether linkage, iodine substitution, O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 506.42 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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.

CATO manufactures O6-benzyl O1-tert-butyl rel-(3R,3aR,7aS)-3-(iodomethyl)-3,3a,4,5,7,7a-hexahydro-2H-pyrrolo[2,3-c]pyridine-1,6-dicarboxylate under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC21H35IN2O4
Molecular Weight506.42 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore in a cool place (≤25°C), protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; 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.)2001
Halogen ContentI-containing
Nitrogen Atoms2

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