Copper acetate monohydrate - ≥99.95% metals basis , CAS No.6046-93-1

CAS: 6046-93-1 Cat. No.: C108085 分子式: C₄H₆CuO₄·H₂O 分子量: 199.65 Beilstein Registry Number: 3730548 EC番号: 611-978-9

グレード＆純度 ≥99.95% metals basis

Synonyms

Copper(II) Acetate Monohydrate | Acetic Acid Copper(II) Salt Monohydrate

Storage

Room temperature

Shipped In

Normal

仕様

同義語

Copper(II) Acetate Monohydrate | Acetic Acid Copper(II) Salt Monohydrate

仕様と純度

≥99.95% metals basis

保管条件

Room temperature

入荷

Normal

純度

≥99.95% metals basis

名前と識別子

パブケム・シド

508811966

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/508811966

カノニカル・スマイル

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

異性体SMILES

CC(=O)[O-].CC(=O)[O-].O.[Cu+2]

WGKドイツ

3

RTECS

AG3500000

UN番号

3077

包装グループ

II

分子量

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
    • 分類 Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid salts
          • Level6 Acetate salts

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: 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
• 説明: 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

化学的性質と物理的性質

• 感度: Moisture sensitive.
• 融点（°C）: 240 °C
• 分子量: 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

XLogP3