Monosodium Maleate Trihydrate - ≥98%(T) , CAS No.3105-55-3

CAS: 3105-55-3 Cat. No.: M158061 Peso molecular: 138.05 Número EC: 221-461-6

GRADE & PURITY ≥98%(T)

Synonyms

Sodium (Z)-3-carboxyacrylate | HY-W127447 | Monosodium maleate | Q27277138 | EINECS 221-461-6 | sodium;(Z)-4-hydroxy-4-oxobut-2-enoate | DTXSID40892502 | UNII-EEL2016S8M | 2-Butenedioic acid (2Z)-, monosodium salt | 2-Butenedioic acid (2Z)-, sodium salt (

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

Sodium (Z)-3-carboxyacrylate | HY-W127447 | Monosodium maleate | Q27277138 | EINECS 221-461-6 | sodium;(Z)-4-hydroxy-4-oxobut-2-enoate | DTXSID40892502 | UNII-EEL2016S8M | 2-Butenedioic acid (2Z)-, monosodium salt | 2-Butenedioic acid (2Z)-, sodium salt (

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Pubchem Sid: 488200410
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488200410
• Sonrisas canónicas: C(=CC(=O)[O-])C(=O)O.[Na+]
• IUPAC Name: sodium;(Z)-4-hydroxy-4-oxobut-2-enoate
• InChIKey: VRVKOZSIJXBAJG-ODZAUARKSA-M
• INCHI: 1S/C4H4O4.Na/c5-3(6)1-2-4(7)8;/h1-2H,(H,5,6)(H,7,8);/q;+1/p-1/b2-1-
• Isómeros SMILES: C(=C\C(=O)[O-])\C(=O)O.[Na+]
• WGK Alemania: 3
• RTECS: ON3500000
• Peso molecular: 138.05
• Reaxy-Rn: 16843392
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=16843392&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: Unsaturated fatty acids Carboxylic acid salts Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty acyl - Fatty acid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Carboxylic acid salt - Organic alkali metal salt - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - 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

• Solubilidad: Soluble in water
• Peso molecular: 138.050 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 137.993 Da
• Monoisotopic Mass: 137.993 Da
• Topological Polar Surface Area: 77.400 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 140.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 2

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