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Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate(CAS: 3618-43-7)

Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate
CAS Number

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Basic Information

Molecular Formula
C31H29N2Na3O13S
Molecular Weight
738.61 g/mol
EINECS
222-805-8

Physical Properties

Melting Point
195 °C (dec.)(lit.)
Boiling Point
904.1°C at 760 mmHg
Flash Point
93.3°C
Water Solubility
510 g/L (20 ºC)

Chemical Identifiers

SMILES
Cc1cc(cc(c1O)CN(CC(=O)O)CC(=O)O[Na])C2(c3ccccc3OS2(=O)=O)c4cc(c(c(c4)CN(CC(=O)O[Na])CC(=O)O[Na])O)C
InChIKey
GAAUERADCKMDLZ-UHFFFAOYSA-K

Database References

MDL Number
MFCD00044293

FAQ

Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate is a complex organic compound with a distinctive molecular structure. It consists of trisodium ions, a benzoxathiol derivative, and two acetate groups. This compound is characterized by its hydrophobic and hydrophilic properties, making it useful in various applications.
Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate is primarily used in pharmaceuticals for drug development, research, and formulation. Its unique chemical properties make it suitable for applications in analytical chemistry and as a reagent in the synthesis of other compounds.
Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate is generally safe when handled with appropriate precautions. Users should avoid contact with eyes and skin, and wear appropriate personal protective equipment. Storage and disposal should follow standard chemical safety guidelines to minimize environmental and health risks.
Trisodium 2,2'-({5-[3-(3-{[(carboxylatomethyl)(carboxymethyl)amino]methyl}-4-hydroxy-5-methylphenyl)-2,2-dioxido-3H-1,2-benzoxathiol-3-yl]-2-hydroxy-3-methylbenzyl}imino)diacetate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container and stored at room temperature (15-25°C) to maintain its stability. Avoid exposure to moisture and maintain good ventilation to prevent degradation.

Safety Notice

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

Always follow proper handling procedures

Contact Information

Email

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