Ethyl 3-bromo-4-cyano-5-iodobenzoate CAS 1804406-07-2

Purity 97%+In StockPharmaceutical Standards
CAS No.1804406-07-2
Molecular FormulaC10H7BrINO2
Molecular Weight379.98 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Ethyl 3-bromo-4-cyano-5-iodobenzoate CAS 1804406-07-2 chemical structure

Description

CATO manufactures Ethyl 3-bromo-4-cyano-5-iodobenzoate 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.

Ethyl 3-bromo-4-cyano-5-iodobenzoate (CAS 1804406-07-2) is a high-purity analytical reference standard with the molecular formula C10H7BrINO2 and a molecular weight of 379.98 g/mol.

Structurally, Ethyl 3-bromo-4-cyano-5-iodobenzoate (C10H7BrINO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine/iodine substitution. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 379.98 g/mol, it falls into the moderately-high-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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.

Physical & Chemical Properties

Molecular FormulaC10H7BrINO2
Molecular Weight379.98 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-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)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1995
Halogen ContentBr/I-containing
Nitrogen Atoms1

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