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

CAS: 137-40-6 Cat. No.: S100120 Summenformel: C₃H₅NaO₂ Molekulargewicht: 96.06 Beilstein Registry Number: 3566934 EG-Nummer: 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

Synonyme

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

Spezifikationen & Reinheit

analytical standard

Storage

Argon charged,Room temperature

Verschickt in

Normal

Note

Analytischer Standard

Namen und Kennungen

Pubchem Sid

528769262

Kanonisches Lächeln

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

Isomere SMILES

CCC(=O)[O-].[Na+]

WGK Deutschland

1

RTECS

UF7525000

PubChem CID

2723816

Molekulargewicht

96.06

Beilstein

3566934

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: 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
• Beschreibung: 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

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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

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FFAR3 Tchem Free fatty acid receptor 3 (304 Activities)

Discover Target: FFAR3

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Carbonic anhydrase (69 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive
• Flammpunkt (°F): > 482 °F
• Flammpunkt (°C): > 250 °C
• Schmelzpunkt (°C): 285-286°C
• Molekulargewicht: 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

XLogP3