Solución de 2-etilhexanoato de cobalto(II) - 65 % en peso en alcohol mineral , CAS No.136-52-7

CAS: 136-52-7 Cat. No.: C282475 Fórmula: C₁₆H₃₀CoO₄ Peso molecular: 345.42 Número EC: 205-250-6

CALIDAD & PUREZA 65 wt. % in mineral spirits

Synonyms

2-etilhexanoato de cobalto | BIS(2-ETILHEXANOATO) DE COBALTO | cobalto(2+);2-etilhexanoato | Sal de cobalto(2+) de ácido 2-etilhexanoico | 2-etilhexanoato de cobalto(II) | C 101 | SCHEMBL37454 | Octoato de cobalto | NL 51S | Ácido hexanoico, 2-etil-, sal

Storage

Room temperature

Especificaciones

Sinónimos

2-etilhexanoato de cobalto | BIS(2-ETILHEXANOATO) DE COBALTO | cobalto(2+);2-etilhexanoato | Sal de cobalto(2+) de ácido 2-etilhexanoico | 2-etilhexanoato de cobalto(II) | C 101 | SCHEMBL37454 | Octoato de cobalto | NL 51S | Ácido hexanoico, 2-etil-, sal

Especificaciones y pureza

65 % en peso en alcohol mineral

Condiciones de almacenamiento de almacenamiento

Room temperature

Nombres e identificadores

Pubchem Sid

488180862

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180862

Sonrisas canónicas

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2]

IUPAC Name

cobalt(2+);2-ethylhexanoate

InChIKey

QAEKNCDIHIGLFI-UHFFFAOYSA-L

INCHI

1S/2C8H16O2.Co/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2

Isómeros SMILES

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Co+2]

Número ONU

1268

Grupo de embalaje

III

Peso molecular

345.42

Reaxy-Rn

4020440

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4020440&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Organic cobalt salts Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Medium-chain fatty acid - Carboxylic acid salt - Organic transition metal salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cobalt salt - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 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

• Punto de inflamación (°C): 104°F
• Peso molecular: 345.340 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 345.148 Da
• Monoisotopic Mass: 345.148 Da
• Topological Polar Surface Area: 80.300 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 93.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3