Sodium tartrate dibasic dihydrate - AR, ≥99% , CAS No.6106-24-7

CAS: 6106-24-7 Cat. No.: S111691 Peso molecular: 230.08 Beilstein Registry Number: 6121732 Número EC: 612-074-7

GRADE & PURITY AR, ≥99%

Synonyms

DTXSID20976556 | HMS1922I06 | EINECS 244-643-7 | Sodium tartrate dibasic dihydrate, BioXtra, >=99.0% | Pharmakon1600-01503262 | Sodium L-(+)-Tartaric Acid Dihydrate | Sodium Tartrate Dihydrate, Pharmaceutical Secondary Standard; Certified Reference Materi

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

DTXSID20976556 | HMS1922I06 | EINECS 244-643-7 | Sodium tartrate dibasic dihydrate, BioXtra, >=99.0% | Pharmakon1600-01503262 | Sodium L-(+)-Tartaric Acid Dihydrate | Sodium Tartrate Dihydrate, Pharmaceutical Secondary Standard; Certified Reference Materi

Especificaciones y pureza

AR, ≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

AR

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488198170
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488198170
• Sonrisas canónicas: C(C(C(=O)[O-])O)(C(=O)[O-])O.O.O.[Na+].[Na+]
• IUPAC Name: disodium;(2R,3R)-2,3-dihydroxybutanedioate;dihydrate
• InChIKey: FGJLAJMGHXGFDE-DGFHWNFOSA-L
• INCHI: 1S/C4H6O6.2Na.2H2O/c5-1(3(7)8)2(6)4(9)10;;;;/h1-2,5-6H,(H,7,8)(H,9,10);;;2*1H2/q;2*+1;;/p-2/t1-,2-;;;;/m1..../s1
• Isómeros SMILES: [C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.O.O.[Na+].[Na+]
• WGK Alemania: 3
• Peso molecular: 230.08
• Beilstein: 6121732
• Reaxy-Rn: 16926950
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=16926950&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Hydroxy acids and derivatives
      • Subclass Beta hydroxy acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Hydroxy acids and derivatives
• Subclass: Beta hydroxy acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Beta hydroxy acids and derivatives
• Alternative Parents: Short-chain hydroxy acids and derivatives Monosaccharides Fatty acids and conjugates Dicarboxylic acids and derivatives Secondary alcohols Carboxylic acid salts 1,2-diols Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Beta-hydroxy acid - Short-chain hydroxy acid - Dicarboxylic acid or derivatives - Monosaccharide - Fatty acid - 1,2-diol - Carboxylic acid salt - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Organic alkali metal salt - Organic sodium salt - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic salt - Organic cation - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
• 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

• Sensibilidad: Moisture sensitive.
• Rotación específica [α]: 26 ° (C=5, H2O)
• Peso molecular: 230.080 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 230.001 Da
• Monoisotopic Mass: 230.001 Da
• Topological Polar Surface Area: 123.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 123.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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: 5

XLogP3

Referencias

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