Sodium isopropoxide - 1.0M in THF , CAS No.683-60-3

CAS: 683-60-3 Cat. No.: S1374041 Fórmula: C₃H₇NaO Peso molecular: 82.08 Número CE: 211-673-7

GRAU & PUREZA 1.0M in THF

Storage

Room temperature

Shipped In

Normal

Especificações

Especificações e pureza

1.0M in THF

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Product Line

S1374041-5g

Nomes e identificadores

Pubchem Sid

528771715

Sorrisos canónicos

CC(C)[O-].[Na+]

IUPAC Name

sodium;propan-2-olate

InChIKey

WBQTXTBONIWRGK-UHFFFAOYSA-N

INCHI

1S/C3H7O.Na/c1-3(2)4;/h3H,1-2H3;/q-1;+1

SMILES isoméricas

CC(C)[O-].[Na+]

Número UN

UN 2056

Grupo de embalagem

II

Peso molecular

82.08

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Classe Organic metal salts
      • Subclass Organic alkali metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Classe: Organic metal salts
• Subclass: Organic alkali metal salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic alkali metal salts
• Alternative Parents: Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Alkoxides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic alkali metal salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic zwitterion - Alkoxide - Organooxygen compound - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as organic alkali metal salts. These are organic salts of an alkali metal. The alkali metal atom is usually in its ionic form.
• 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

Propriedades químicas e físicas

• Ponto de fusão (°C): 70-75°C
• Peso molecular: 82.080 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 82.0395 Da
• Monoisotopic Mass: 82.0395 Da
• Topological Polar Surface Area: 23.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 14.400
• 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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