Sodium tert-pentoxide - 2.5M (30 wt%) in THF , CAS No.14593-46-5

CAS: 14593-46-5 Cat. No.: S140673 Summenformel: NaOC(CH₃)₂CH₂CH₃ Molekulargewicht: 110.13 Beilstein Registry Number: 3983987 EG-Nummer: 238-639-4 PubChem CID: 2733478

GRADE & PURITY 2.5M (30 wt%) in THF

Synonyms

AMY33539 | Sodium 2-methyl-2-butoxide, 25% in Toluene | EINECS 238-639-4 | Sodium 2-methylbutan-2-olate | Q27260933 | Sodium tert-pentoxide, 3M in THF | 51Z39PY5Z8 | Sodium-t-amylate | S0950 | 2-Butanol, 2-methyl-, sodium salt | Sodium tert-Pentylate | CG

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Specifications

Synonyme

AMY33539 | Sodium 2-methyl-2-butoxide, 25% in Toluene | EINECS 238-639-4 | Sodium 2-methylbutan-2-olate | Q27260933 | Sodium tert-pentoxide, 3M in THF | 51Z39PY5Z8 | Sodium-t-amylate | S0950 | 2-Butanol, 2-methyl-, sodium salt | Sodium tert-Pentylate | CG

Spezifikationen & Reinheit

2.5M (30 wt%) in THF

Storage

Room temperature,Argon charged,Desiccated

Verschickt in

Normal

Namen und Kennungen

Pubchem Sid

508812855

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812855

Kanonisches Lächeln

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

IUPAC Name

sodium;2-methylbutan-2-olate

InChIKey

CGRKYEALWSRNJS-UHFFFAOYSA-N

INCHI

1S/C5H11O.Na/c1-4-5(2,3)6;/h4H2,1-3H3;/q-1;+1

Isomere SMILES

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

WGK Deutschland

1

PubChem CID

2733478

UN-Nummer

3206

Verpackungsgruppe

II

Molekulargewicht

110.13

Beilstein

3983987

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic salts
• Klasse: 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
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: air & Moisture sensitive
• Brechungsindex: 1.415
• Flammpunkt (°F): -17 °C
• Flammpunkt (°C): -17°C
• Molekulargewicht: 110.130 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 110.071 Da
• Monoisotopic Mass: 110.071 Da
• Topological Polar Surface Area: 23.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 43.300
• 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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