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CAS 125572-95-4

:

rel-N,N′-(1R,2R)-1,2-Cyclohexanediylbis[N-(carboxymethyl)glycine hydrate (1:1)

Description:
The chemical substance known as rel-N,N′-(1R,2R)-1,2-Cyclohexanediylbis[N-(carboxymethyl)glycine hydrate (1:1), with CAS number 125572-95-4, is a chelating agent commonly used in coordination chemistry and biochemistry. This compound features a cyclohexane backbone with two carboxymethylglycine moieties, which enhance its ability to form stable complexes with metal ions. The presence of the carboxymethyl groups contributes to its solubility in aqueous solutions, making it suitable for various applications, including in biological systems and as a potential therapeutic agent. The hydrate form indicates that it contains water molecules in its structure, which can influence its stability and reactivity. Additionally, the specific stereochemistry (1R,2R) suggests that the compound has defined spatial arrangements that may affect its interaction with biological targets. Overall, this compound's unique structural features and chelating properties make it of interest in fields such as medicinal chemistry, environmental science, and materials science.
Formula:C14H22N2O8·H2O
InChI:InChI=1/C14H22N2O8.H2O/c17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24;/h9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24);1H2/t9-,10-;/s2
InChI key:InChIKey=VASZYFIKPKYGNC-RQOWPVKJNA-N
SMILES:N(CC(O)=O)(CC(O)=O)[C@H]1[C@H](N(CC(O)=O)CC(O)=O)CCCC1.O
Synonyms:
  • 2,2',2'',2'''-[(1R,2R)-cyclohexane-1,2-diyldiammonio]tetraacetate monohydrate
  • 2,2',2'',2'''-[(1R,2R)-cyclohexane-1,2-diyldinitrilo]tetraacetic acid hydrate
  • 2,2',2'',2'''-[(1S,2S)-Cyclohexane-1,2-diyldinitrilo]tetraacetic acid monohydrate
  • Glycine, N,N′-(1R,2R)-1,2-cyclohexanediylbis[N-(carboxymethyl)-, hydrate (1:1), rel-
  • Glycine, N,N′-(1R,2R)-1,2-cyclohexanediylbis[N-(carboxymethyl)-, monohydrate, rel-
  • Glycine, N,N′-1,2-cyclohexanediylbis[N-(carboxymethyl)-, monohydrate, trans-(±)-
  • rel-N,N′-(1R,2R)-1,2-Cyclohexanediylbis[N-(carboxymethyl)glycine hydrate (1:1)
  • trans-1,2-Diaminocyclohexane-N,N,N′,N′-tetraacetic acid monohydrate
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