Copper acetylacetonate - ≥97% , CAS No.13395-16-9

CAS: 13395-16-9 Cat. No.: C109323 Formula: C_1OH₁₄CuO₄ Molecular Weight: 261.76 Beilstein Registry Number: 4157957 EC Number: 236-477-9 PubChem CID: 6433572

GRADE & PURITY ≥97%

Synonyms

Copper(II) acetylacetonate, 97% | MFCD00000016 | AKOS002375192 | bis(((Z)-4-oxopent-2-en-2-yl)oxy)copper | Copper(II) acetylacetonate, >=99.9% trace metals basis | H11255 | copper;(Z)-4-hydroxypent-3-en-2-one | Copper(II) 2,4-pentanedionate | Cu(acac)2 |

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonyms

Copper(II) acetylacetonate, 97% | MFCD00000016 | AKOS002375192 | bis(((Z)-4-oxopent-2-en-2-yl)oxy)copper | Copper(II) acetylacetonate, >=99.9% trace metals basis | H11255 | copper;(Z)-4-hydroxypent-3-en-2-one | Copper(II) 2,4-pentanedionate | Cu(acac)2 |

Specifications & Purity

≥97%

Storage

Room temperature,Desiccated

Shipped In

Normal

Purity

≥97%

Names and Identifiers

Pubchem Sid

504764152

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504764152

Canonical Smiles

CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Cu]

IUPAC Name

copper;(Z)-4-hydroxypent-3-en-2-one

InChIKey

ZKXWKVVCCTZOLD-FDGPNNRMSA-N

INCHI

1S/2C5H8O2.Cu/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/b2*4-3-;

Isomeric SMILES

C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Cu]

WGK Germany

3

RTECS

GL6520000

PubChem CID

6433572

Molecular Weight

261.76

Beilstein

4157957

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Alpha,beta-unsaturated carbonyl compounds
          • Level6 Alpha,beta-unsaturated ketones
            • Level7 Enones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Alpha,beta-unsaturated carbonyl compounds - Alpha,beta-unsaturated ketones
• Direct Parent: Enones
• Alternative Parents: Vinylogous acids Acryloyl compounds Ketones Organic transition metal salts Enols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Vinylogous acid - Enone - Acryloyl-group - Ketone - Organic transition metal salt - Enol - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as enones. These are compounds containing the enone functional group, with the structure RC(=O)CR'.
• 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

• Solubility: Slightly soluble in water. Soluble in alcohol.
• Sensitivity: Hygroscopic.
• Boil Point(°C): 160 °C/10 mmHg
• Melt Point(°C): 284-288°C
• Molecular Weight: 263.780 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 263.034 Da
• Monoisotopic Mass: 263.034 Da
• Topological Polar Surface Area: 74.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 239.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 3

XLogP3

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store in a cool place, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 13395-16-9, the molecular formula is C10H14CuO4, and the molecular weight is 261.76 g/mol. InChIKey ZKXWKVVCCTZOLD-FDGPNNRMSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.