Poly-(α,β)-DL-aspartic acid sodium salt - mol wt 2,000-11,000 , CAS No.94525-01-6

CAS: 94525-01-6 Cat. No.: P477791 Peso molecular: 177.07 Número EC: 686-842-5 PubChem CID: 21806

GRADE & PURITY mol wt 2,000-11,000

Synonyms

Disodium L-aspartate | disodium;(2S)-2-aminobutanedioate | Q27259155 | Aspartic acid, sodium salt | EINECS 241-155-6 | E81729 | Sodium L-aspartate | DISODIUM L-ASPARTIC AICD | DTXSID501014348 | (S)-2-Aminosuccinic acid, sodium salt | XMXOIHIZTOVVFB-JIZZDE

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

Disodium L-aspartate | disodium;(2S)-2-aminobutanedioate | Q27259155 | Aspartic acid, sodium salt | EINECS 241-155-6 | E81729 | Sodium L-aspartate | DISODIUM L-ASPARTIC AICD | DTXSID501014348 | (S)-2-Aminosuccinic acid, sodium salt | XMXOIHIZTOVVFB-JIZZDE

Especificaciones y pureza

mol wt 2, 000-11, 000

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nombres e identificadores

• Sonrisas canónicas: C(C(C(=O)[O-])N)C(=O)[O-].[Na+].[Na+]
• IUPAC Name: disodium;(2S)-2-aminobutanedioate
• InChIKey: XMXOIHIZTOVVFB-JIZZDEOASA-L
• INCHI: 1S/C4H7NO4.2Na/c5-2(4(8)9)1-3(6)7;;/h2H,1,5H2,(H,6,7)(H,8,9);;/q;2*+1/p-2/t2-;;/m0../s1
• Isómeros SMILES: C([C@@H](C(=O)[O-])N)C(=O)[O-].[Na+].[Na+]
• PubChem CID: 21806
• Peso molecular: 177.07

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 Aspartic acid and derivatives

• 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: Aspartic acid and derivatives
• Alternative Parents: L-alpha-amino acids Fatty acids and conjugates Dicarboxylic acids and derivatives Carboxylic acid salts Amino acids Carboxylic acids Organopnictogen compounds Organic zwitterions Organic sodium salts Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Aspartic acid or derivatives - Alpha-amino acid - L-alpha-amino acid - Dicarboxylic acid or derivatives - Fatty acid - Carboxylic acid salt - Amino acid - Carboxylic acid - Organic alkali metal salt - Organic nitrogen compound - Organic sodium salt - Organopnictogen compound - Organic salt - Organic zwitterion - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic oxide - Carbonyl group - Amine - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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

• Punto de inflamación (°F): Not applicable
• Punto de inflamación (°C): Not applicable
• Peso molecular: 177.070 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 177.001 Da
• Monoisotopic Mass: 177.001 Da
• Topological Polar Surface Area: 106.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 122.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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: 3

XLogP3

Referencias

1. Ziying You, Yue Yu, Tie Hua Wang, Chenglin Wang, Ding Xiong, Yu Shi, Zhenming Wang, Ling Ye.  (2023)  Divalent Anion-Induced Biohydrogels with High Strength, Anti-swelling, and Bioactive Capability for Enhanced Skull Bone Regeneration.  ACS Applied Materials & Interfaces,      [PMID:37350582] [10.1021/acsami.3c04729]

2. Yan Wang, Bo Ding, Qingqing Bao, Yunying Zhao, Guohui Li, Yu Deng.  (2025)  One-pot synthesis of arginine decarboxylase@ZIF-8 using intrinsic pyridoxal 5′-phosphate cofactor for agmatine production.  BIOCHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.bej.2025.109730]