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

CAS: 683-60-3 Cat. No.: S1374041 Formula: C₃H₇NaO Peso molecolare: 82.08 Numero EC: 211-673-7

GRADE & PURITY 1.0M in THF

Storage

Room temperature

Shipped In

Normal

Specifications

Specifiche e purezza

1.0M in THF

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

• Pubchem Sid: 528771715
• Sorrisi canonici: 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
• Isomeri SMILES: CC(C)[O-].[Na+]
• Numero UN: UN 2056
• Gruppo di imballaggio: II
• Peso molecolare: 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
• Descrizione: 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 70-75°C
• Peso molecolare: 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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