Copper(II) acetate monohydrate - 99.0% , CAS No.6046-93-1

CAS: 6046-93-1 Cat. No.: C105398 Summenformel: C₄H₆CuO₄·H₂O Molekulargewicht: 199.65 Beilstein Registry Number: 3730548 EG-Nummer: 611-978-9

Synonyms

CUPRIC ACETATE MONOHYDRATE [MI] | FT-0624043 | J-520115 | copper (II) acetate mono hydrate | Copper (II) Acetate Monohydrate | 39J9V52S86 | copper acetate-monohydrate | AKOS015907686 | Copper(2+) acetate, monohydrate | Cupric acetate monohydrate | COPPER

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Specifications

Synonyme

CUPRIC ACETATE MONOHYDRATE [MI] | FT-0624043 | J-520115 | copper (II) acetate mono hydrate | Copper (II) Acetate Monohydrate | 39J9V52S86 | copper acetate-monohydrate | AKOS015907686 | Copper(2+) acetate, monohydrate | Cupric acetate monohydrate | COPPER

Spezifikationen & Reinheit

99.0%

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Namen und Kennungen

• Kanonisches Lächeln: CC(=O)[O-].CC(=O)[O-].O.[Cu+2]
• IUPAC Name: copper;diacetate;hydrate
• InChIKey: NWFNSTOSIVLCJA-UHFFFAOYSA-L
• INCHI: 1S/2C2H4O2.Cu.H2O/c2*1-2(3)4;;/h2*1H3,(H,3,4);;1H2/q;;+2;/p-2
• Isomere SMILES: CC(=O)[O-].CC(=O)[O-].O.[Cu+2]
• WGK Deutschland: 3
• RTECS: AG3500000
• UN-Nummer: 3077
• Verpackungsgruppe: II
• Molekulargewicht: 199.65
• Beilstein: 3730548
• Reaxy-Rn: 3730548
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3730548&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Ebene5 Carboxylic acid salts
          • Ebene6 Acetate salts

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid salts
• Direct Parent: Acetate salts
• Alternative Parents: Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Organic copper salts Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Acetate salt - Organic transition metal salt - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic copper salt - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive.
• Schmelzpunkt (°C): 240 °C
• Molekulargewicht: 199.650 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 198.967 Da
• Monoisotopic Mass: 198.967 Da
• Topological Polar Surface Area: 81.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 25.500
• 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: 4

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