Ccesium acetate - ≥99.9% metals basis , CAS No.3396-11-0

CAS: 3396-11-0 Cat. No.: C106020 Formula: C₂H₃CsO₂ Molecular Weight: 191.95 Beilstein Registry Number: 3595637 EC Number: 222-248-0

GRADE & PURITY ≥99.9% metals basis

Synonyms

Acetic Acid Cesium Salt | J-019399 | Cesium acetate, technical grade, >=95% | C2430 | Cesium acetate, Vetec(TM) reagent grade, 95% | EINECS 222-248-0 | AKOS015950491 | MFCD00013056 | DTXSID00883971 | C2H3CsO2 | Cesium acetate, >=99.99% trace metals basis

Storage

Desiccated,Room temperature

Shipped In

Normal

Specifications

Synonyms

Acetic Acid Cesium Salt | J-019399 | Cesium acetate, technical grade, >=95% | C2430 | Cesium acetate, Vetec(TM) reagent grade, 95% | EINECS 222-248-0 | AKOS015950491 | MFCD00013056 | DTXSID00883971 | C2H3CsO2 | Cesium acetate, >=99.99% trace metals basis

Specifications & Purity

≥99.9% metals basis

Storage

Desiccated,Room temperature

Shipped In

Normal

Purity

≥99.9% metals basis

Names and Identifiers

• Pubchem Sid: 508811969
• Canonical Smiles: CC(=O)[O-].[Cs+]
• IUPAC Name: cesium;acetate
• InChIKey: ZOAIGCHJWKDIPJ-UHFFFAOYSA-M
• INCHI: 1S/C2H4O2.Cs/c1-2(3)4;/h1H3,(H,3,4);/q;+1/p-1
• Isomeric SMILES: CC(=O)[O-].[Cs+]
• WGK Germany: 3
• Molecular Weight: 191.95
• Beilstein: 3595637
• Reaxy-Rn: 3595637
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3595637&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid salts
          • Level6 Acetate salts

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid salts
• Direct Parent: Acetate salts
• Alternative Parents: Organic alkali metal salts Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acetate salt - Organic alkali metal salt - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acetate salts. These are organic compounds containing acetic acid as its acid component.
• 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

Chemical and Physical Properties

• Sensitivity: Hygroscopic.
• Melt Point(°C): 194°C
• Molecular Weight: 191.950 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 191.919 Da
• Monoisotopic Mass: 191.919 Da
• Topological Polar Surface Area: 40.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 34.600
• 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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