Succinic acid-d6 - ≥98 atom% D , CAS No.21668-90-6

CAS: 21668-90-6 Cat. No.: S303059 Peso molecular: 124.13 Número EC: 693-180-0

GRADE & PURITY ≥98 atom% D

Synonyms

HY-N0420S | Butanedioic acid-d6 | Succinic-d4 acid-d2 | Succinic acid-d6 | A935658 | MS-22762 | DTXSID20583921 | D99190 | dideuterio 2,2,3,3-tetradeuteriobutanedioate | (~2~H_4_)Butane(~2~H_2_)dioic acid | SCHEMBL1331059 | Succinic acid-d6, 98 atom % D

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

HY-N0420S | Butanedioic acid-d6 | Succinic-d4 acid-d2 | Succinic acid-d6 | A935658 | MS-22762 | DTXSID20583921 | D99190 | dideuterio 2, 2, 3, 3-tetradeuteriobutanedioate | (~2~H_4_)Butane(~2~H_2_)dioic acid | SCHEMBL1331059 | Succinic acid-d6, 98 atom % D

Especificaciones y pureza

≥98 atom% D

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

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

Pureza

≥98 atom% D

Nombres e identificadores

• Sonrisas canónicas: C(CC(=O)O)C(=O)O
• IUPAC Name: dideuterio 2,2,3,3-tetradeuteriobutanedioate
• InChIKey: KDYFGRWQOYBRFD-DTDGFSOZSA-N
• INCHI: 1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/i1D2,2D2/hD2
• Isómeros SMILES: [2H]C([2H])(C(=O)O[2H])C([2H])([2H])C(=O)O[2H]
• Peso molecular: 124.13
• Reaxy-Rn: 1754069
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1754069&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Dicarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Fatty acids and conjugates Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty acid - Dicarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
• 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: Hygroscopic
• Punto de ebullición (°C): 235°C
• Punto de fusión (°C): 187-190°C
• Peso molecular: 124.120 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 124.064 Da
• Monoisotopic Mass: 124.064 Da
• Topological Polar Surface Area: 74.600 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 92.600
• Isotope Atom Count: 6
• 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

Referencias

1. Wei Li, Jiangyan Huo, Entezar Berik, Wenyong Wu, Jinjun Hou, Huali Long, Min Lei, Zhaoxia Li, Zijia Zhang, Wanying Wu.  (2023)  Determination of the intermediates in glycolysis and tricarboxylic acid cycle with an improved derivatization strategy using gas chromatography-mass spectrometry in complex samples.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:36803770] [10.1016/j.chroma.2023.463856]