Stearato di sodio - ≥96% , CAS No.822-16-2

CAS: 822-16-2 Cat. No.: S108363 Formula: C₁₈H₃₅NaO₂ Peso molecolare: 306.46 Beilstein Registry Number: 3576813 Numero EC: 212-490-5 PubChem CID: 2724691

GRADE & PURITY ≥96%

Synonyms

HSDB 5759 | HY-W099570 | Stearic acid, sodium salt | Octadecanoic acid, sodium salt | RYYKJJJTJZKILX-UHFFFAOYSA-M | INS NO.470(I)STEARIC ACID, SODIUM SALT | Prifer 1634 | SODIUM STEARATE [INCI] | C18H35NaO2 | Nonsoul sn 15 | Sodium stearate, pure | MFCD00

Storage

Room temperature

Shipped In

Normale

Specifications

Sinonimi

HSDB 5759 | HY-W099570 | Stearic acid, sodium salt | Octadecanoic acid, sodium salt | RYYKJJJTJZKILX-UHFFFAOYSA-M | INS NO.470(I)STEARIC ACID, SODIUM SALT | Prifer 1634 | SODIUM STEARATE [INCI] | C18H35NaO2 | Nonsoul sn 15 | Sodium stearate, pure | MFCD00

Specifiche e purezza

≥96%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normale

Purezza

≥96%

Nomi e identificatori

Pubchem Sid

488192302

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488192302

Sorrisi canonici

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

IUPAC Name

sodium;octadecanoate

InChIKey

RYYKJJJTJZKILX-UHFFFAOYSA-M

INCHI

1S/C18H36O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1

Isomeri SMILES

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

WGK Germania

1

RTECS

WI4725000

PubChem CID

2724691

Peso molecolare

306.46

Beilstein

3576813

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Long-chain fatty acids
• Alternative Parents: Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long-chain fatty acid - Carboxylic acid salt - Organic alkali metal salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - 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 long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 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

Obiettivi associati (umani)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

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

Obiettivi associati (non umani)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Slowly soluble in cold water. Solubility increases with temperature
• Punto di fusione (°C): 220 °C
• Peso molecolare: 306.500 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 16
• Exact Mass: 306.253 Da
• Monoisotopic Mass: 306.253 Da
• Topological Polar Surface Area: 40.100 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 207.000
• 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