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2,2',2'',2'''-{(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylenenitrilo]}tetraacetic acid(CAS: 2411-89-4)

2,2',2'',2'''-{(3-Oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylenenitrilo]}tetraacetic acid
CAS Number

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Basic Information

Molecular Formula
C32H32N2O12
Molecular Weight
636.61 g/mol

Physical Properties

Melting Point
181-185 °C (dec.) (lit.)
Boiling Point
892.1°C at 760 mmHg
Density
1.5150

Chemical Identifiers

SMILES
CC1=CC(=CC(=C1O)CN(CC(=O)O)CC(=O)O)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)C)O)CN(CC(=O)O)CC(=O)O
InChIKey
IYZPEGVSBUNMBE-UHFFFAOYSA-N

Database References

MDL Number
MFCD00005911
Beilstein Registry Number
381994

FAQ

This compound is a tetraacetic acid derivative with a complex structure. It is typically a white to off-white crystalline solid with a high molecular weight. Its solubility in water is relatively low, but it is highly soluble in organic solvents. Chemically, it is known for its reactivity, particularly in chelation reactions, due to the multiple carboxylic acid groups. It exhibits good stability under normal conditions but can react with metal ions to form stable complexes.
The synthesis of this compound usually involves multi-step reactions starting from the appropriate precursors. Common methods include condensation reactions and multi-component reactions. The synthesis often requires careful control of reaction conditions to ensure selectivity and yield. Suitable catalysts and reagents are used to facilitate the reaction and improve efficiency.
This compound is primarily used in the pharmaceutical and biochemical industries for its chelating properties. It is also relevant in the production of advanced materials and sensors. Its unique structure makes it valuable in research and development for applications in drug discovery, polymer chemistry, and semiconductor technology.
Proper personal protective equipment (PPE) is essential when handling this compound. Wear gloves, safety goggles, and a lab coat at all times. Store it in a cool, dry place away from direct sunlight and flammable materials. Use a fume hood during preparation and manipulation to avoid inhalation. Always refer to the safety data sheet (SDS) for detailed handling instructions and emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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