Cupric citrate - ≥99.5% metals basis , CAS No.10402-15-0

CAS: 10402-15-0 Cat. No.: C104713 Formula: C₆H₄Cu₂O₇·2.5H₂O Molecular Weight: 360.22 EC Number: 641-381-9 PubChem CID: 61514

GRADE & PURITY ≥99.5% metals basis

Synonyms

Copper citrate

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Copper citrate

Specifications & Purity

≥99.5% metals basis

Storage

Room temperature

Shipped In

Normal

Purity

≥99.5% metals basis

Names and Identifiers

Pubchem Sid

488183506

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488183506

Canonical Smiles

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

IUPAC Name

copper;2-hydroxypropane-1,2,3-tricarboxylic acid

InChIKey

QDUNDCWSEGVAAB-UHFFFAOYSA-N

INCHI

1S/C6H8O7.Cu/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+2

Isomeric SMILES

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

PubChem CID

61514

Molecular Weight

360.22

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Tricarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Tricarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Tricarboxylic acids and derivatives
• Alternative Parents: Alpha hydroxy acids and derivatives Tertiary alcohols Carboxylic acids Organic oxides Organic copper salts Hydrocarbon derivatives Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tricarboxylic acid or derivatives - Alpha-hydroxy acid - Hydroxy acid - Tertiary alcohol - Carboxylic acid - Organic transition metal salt - Organic copper salt - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Carbonyl group - Organic oxygen compound - Organic salt - Organic cation - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
• 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 acid or alkali solutions
• Sensitivity: Moisture sensitive.
• Molecular Weight: 255.670 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 254.957 Da
• Monoisotopic Mass: 254.957 Da
• Topological Polar Surface Area: 132.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 2
• Complexity: 227.000
• 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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