4-Hydroxyvaleric acid sodium salt - ≥95% , CAS No.56279-37-9

CAS: 56279-37-9 Cat. No.: H337910 Peso molecular: 140.11 Número EC: 829-949-6

GRADE & PURITY ≥95%

Synonyms

GHV sodium salt | AS-81113 | GHV (sodium salt) | MFCD28023743 | MEGFTCUCXBRUTB-UHFFFAOYSA-M | EN300-176456 | Pentanoic acid, 4-hydroxy-, monosodium salt | AKOS026744602 | sodium4-hydroxypentanoate | sodium 4-hydroxypentanoate | SCHEMBL311418 | SY159293 |

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

GHV sodium salt | AS-81113 | GHV (sodium salt) | MFCD28023743 | MEGFTCUCXBRUTB-UHFFFAOYSA-M | EN300-176456 | Pentanoic acid, 4-hydroxy-, monosodium salt | AKOS026744602 | sodium4-hydroxypentanoate | sodium 4-hydroxypentanoate | SCHEMBL311418 | SY159293 |

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(CCC(=O)[O-])O.[Na+]
• IUPAC Name: sodium;4-hydroxypentanoate
• InChIKey: MEGFTCUCXBRUTB-UHFFFAOYSA-M
• INCHI: 1S/C5H10O3.Na/c1-4(6)2-3-5(7)8;/h4,6H,2-3H2,1H3,(H,7,8);/q;+1/p-1
• Isómeros SMILES: CC(CCC(=O)[O-])O.[Na+]
• CAS alternativo: 13532-37-1
• Peso molecular: 140.11
• Reaxy-Rn: 4015292
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4015292&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Hydroxy acids and derivatives
      • Subclass Short-chain hydroxy acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Hydroxy acids and derivatives
• Subclass: Short-chain hydroxy acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Short-chain hydroxy acids and derivatives
• Alternative Parents: Fatty acids and conjugates Secondary alcohols Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Short-chain hydroxy acid - Fatty acid - Carboxylic acid salt - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic alkali metal salt - Organic sodium salt - Organic oxide - Organic salt - Organic zwitterion - Organic oxygen compound - Organooxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as short-chain hydroxy acids and derivatives. These are hydroxy acids with an alkyl chain the contains less than 6 carbon atoms.
• 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: 140.110 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 140.045 Da
• Monoisotopic Mass: 140.045 Da
• Topological Polar Surface Area: 60.400 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 84.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• 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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