Methyl 5-bromo-4-cyano-2-iodobenzoate CAS 1805487-77-7

Purity 97%+In StockPharmaceutical Standards
CAS No.1805487-77-7
Molecular FormulaC9H5BrINO2
Molecular Weight365.95 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Methyl 5-bromo-4-cyano-2-iodobenzoate CAS 1805487-77-7 chemical structure

Description

The occurrence of Methyl 5-bromo-4-cyano-2-iodobenzoate is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine/iodine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

Methyl 5-bromo-4-cyano-2-iodobenzoate (CAS 1805487-77-7) is a high-purity analytical reference standard with the molecular formula C9H5BrINO2 and a molecular weight of 365.95 g/mol.

Structurally, Methyl 5-bromo-4-cyano-2-iodobenzoate (C9H5BrINO2) 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 365.95 g/mol, it falls into the moderately-high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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

CATO manufactures Methyl 5-bromo-4-cyano-2-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.

Physical & Chemical Properties

Molecular FormulaC9H5BrINO2
Molecular Weight365.95 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 methanol, acetonitrile, DMSO, water (slightly soluble)
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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