ADA sodium salt - ≥99% , CAS No.7415-22-7

CAS: 7415-22-7 Cat. No.: A113009 Peso molecular: 212.14 PubChem CID: 23679048

GRADE & PURITY ≥99%

Synonyms

E78588 | AS-83164 | Sodium2-((2-amino-2-oxoethyl)(carboxymethyl)amino)acetate | Sodium [(2-amino-2-oxoethyl)(carboxymethyl)amino]acetate | FT-0629095 | N-(2-Acetamido)iminodiacetic acidmonosodium salt | Sodium 2-((2-amino-2-oxoethyl)(carboxymethyl)amino)a

Storage

Room temperature

Shipped In

Normal

Descripción general

useful pH range 6.0 - 7.2 pKa (25 °C) 6.6 (Free acid) cation traces Pb: <5 ppm

Specifications

Sinónimos

E78588 | AS-83164 | Sodium2-((2-amino-2-oxoethyl)(carboxymethyl)amino)acetate | Sodium [(2-amino-2-oxoethyl)(carboxymethyl)amino]acetate | FT-0629095 | N-(2-Acetamido)iminodiacetic acidmonosodium salt | Sodium 2-((2-amino-2-oxoethyl)(carboxymethyl)amino)a

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

• Sonrisas canónicas: C(C(=O)N)N(CC(=O)O)CC(=O)[O-].[Na+]
• IUPAC Name: sodium;2-[(2-amino-2-oxoethyl)-(carboxymethyl)amino]acetate
• InChIKey: QCGKKVWCABJQQI-UHFFFAOYSA-M
• INCHI: 1S/C6H10N2O5.Na/c7-4(9)1-8(2-5(10)11)3-6(12)13;/h1-3H2,(H2,7,9)(H,10,11)(H,12,13);/q;+1/p-1
• Isómeros SMILES: C(C(=O)N)N(CC(=O)O)CC(=O)[O-].[Na+]
• WGK Alemania: 3
• PubChem CID: 23679048
• Peso molecular: 212.14

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 acid amides

• 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 acid amides
• Alternative Parents: Alpha amino acids Dicarboxylic acids and derivatives Trialkylamines Primary carboxylic acid amides Carboxylic acid salts Amino acids Carboxylic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid amide - Alpha-amino acid - Dicarboxylic acid or derivatives - Carboxamide group - Carboxylic acid salt - Primary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid - Carboxylic acid - Organic alkali metal salt - Carbonyl group - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
• 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

• Peso molecular: 212.140 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 212.041 Da
• Monoisotopic Mass: 212.041 Da
• Topological Polar Surface Area: 124.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 232.000
• 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: 2

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