N-(2-Hydroxyethyl)iminodiacetic Acid(HIDA) - ≥98%(T) , CAS No.93-62-9

CAS: 93-62-9 Cat. No.: N159336 Peso molecular: 177.16 Beilstein Registry Number: 1780630 Número EC: 202-263-9

GRADE & PURITY ≥98%(T)

Synonyms

(2-Hydroxyethyl)iminodiacetic acid | 2,2'-(2-hydroxyethylazanediyl)diacetic acid | 2,2'-((2-Hydroxyethyl)azanediyl)diacetic acid | EINECS 202-263-9 | NSC 18474 | Heida | DTXSID4042177 | BPQ4R5AF5K | MFCD00004293 | NSC18474 | USAF DO-37 | Acetic acid, (hyd

Storage

Room temperature

Shipped In

Normal

Descripción general

N-(2-Hydroxyethyl)iminodiacetic acid (HEIDA) is a biodegradable and strong metal chelating agent, similar to nitrilotriacetic acid (NTA).

N-(2-Hydroxyethyl)iminodiacetic acid (HEIDA) can be used in the following processes:

• HEIDA can be used as a metal chelating agent for Fe(III) ion. The presence of HEIDA improves the Fenton’s destruction performance of PCE (perchloroethylene) existing as dense non-aqueous phase liquid (DNAPL) in soil slurry systems.

• Oxorhenium(V) complexes with HEIDA are used for the carboxylation of ethane by CO, with potassium peroxodisulfate (K2S2O8)/trifluoroacetic acid (TFA), to afford propionic and acetic acid in good yield.

• Vanadium complexes with HEIDA are used for the peroxidative hydroxylation of benzene and oxidation of mesitylene.

Specifications

Sinónimos

(2-Hydroxyethyl)iminodiacetic acid | 2, 2'-(2-hydroxyethylazanediyl)diacetic acid | 2, 2'-((2-Hydroxyethyl)azanediyl)diacetic acid | EINECS 202-263-9 | NSC 18474 | Heida | DTXSID4042177 | BPQ4R5AF5K | MFCD00004293 | NSC18474 | USAF DO-37 | Acetic acid, (hyd

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Pubchem Sid: 488180315
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180315
• Sonrisas canónicas: C(CO)N(CC(=O)O)CC(=O)O
• IUPAC Name: 2-[carboxymethyl(2-hydroxyethyl)amino]acetic acid
• InChIKey: JYXGIOKAKDAARW-UHFFFAOYSA-N
• INCHI: 1S/C6H11NO5/c8-2-1-7(3-5(9)10)4-6(11)12/h8H,1-4H2,(H,9,10)(H,11,12)
• Isómeros SMILES: C(CO)N(CC(=O)O)CC(=O)O
• WGK Alemania: 3
• RTECS: AI1925000
• CAS alternativo: 93-62-9
• Peso molecular: 177.16
• Beilstein: 1780630
• Reaxy-Rn: 1780628
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1780628&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acids
• Alternative Parents: Dicarboxylic acids and derivatives Trialkylamines Amino acids 1,2-aminoalcohols Carboxylic acids Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Dicarboxylic acid or derivatives - 1,2-aminoalcohol - Amino acid - Tertiary aliphatic amine - Tertiary amine - Alkanolamine - Carboxylic acid - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Organopnictogen compound - Organic oxygen compound - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Solubility in hot Water almost transparency
• Punto de fusión (°C): 178 °C
• Peso molecular: 177.160 g/mol
• XLogP3: -3.500
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 177.064 Da
• Monoisotopic Mass: 177.064 Da
• Topological Polar Surface Area: 98.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 153.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1