Sodium propionate - analytical standard , CAS No.137-40-6

CAS: 137-40-6 Cat. No.: S100120 Formula: C₃H₅NaO₂ Peso molecolare: 96.06 Beilstein Registry Number: 3566934 Numero EC: 205-290-4 PubChem CID: 2723816

GRADE & PURITY Analytical standard

Synonyms

SODIUM PROPIONATE|137-40-6|Sodium propanoate|Propionic acid sodium salt|Propanoic acid, sodium salt|SODIUMPROPIONATE|sodium;propanoate|Propionic acid, sodium salt|Sodium propionate anhydrous|Natriumpropionat|Mycoban|Sodium hydrogen dipropionate|Propanoic

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

SODIUM PROPIONATE | 137-40-6 | Sodium propanoate | Propionic acid sodium salt | Propanoic acid, sodium salt | SODIUMPROPIONATE | sodium;propanoate | Propionic acid, sodium salt | Sodium propionate anhydrous | Natriumpropionat | Mycoban | Sodium hydrogen dipropionate | Propanoic

Specifiche e purezza

analytical standard

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Grado

Standard analitico

Nomi e identificatori

• Pubchem Sid: 528769262
• Sorrisi canonici: CCC(=O)[O-].[Na+]
• IUPAC Name: sodium;propanoate
• InChIKey: JXKPEJDQGNYQSM-UHFFFAOYSA-M
• INCHI: 1S/C3H6O2.Na/c1-2-3(4)5;/h2H2,1H3,(H,4,5);/q;+1/p-1
• Isomeri SMILES: CCC(=O)[O-].[Na+]
• WGK Germania: 1
• RTECS: UF7525000
• PubChem CID: 2723816
• Peso molecolare: 96.06
• Beilstein: 3566934

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acid salts
• Alternative Parents: Monocarboxylic acids and derivatives Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carboxylic acid salt - Organic alkali metal salt - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as carboxylic acid salts. These are ionic derivatives of carboxylic acid.
• 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

Obiettivi associati (umani)

CA2 Tclin Carbonic anhydrase II (17698 Activities)

Discover Target: CA2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CA1 Tclin Carbonic anhydrase I (13240 Activities)

Discover Target: CA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

FFAR3 Tchem Free fatty acid receptor 3 (304 Activities)

Discover Target: FFAR3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Obiettivi associati (non umani)

Carbonic anhydrase (69 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Punto di infiammabilità (°F): > 482 °F
• Punto di infiammabilità (°C): > 250 °C
• Punto di fusione (°C): 285-286°C
• Peso molecolare: 96.060 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 96.0187 Da
• Monoisotopic Mass: 96.0187 Da
• Topological Polar Surface Area: 40.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 44.100
• Isotope Atom Count: 0
• 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: 2

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