Iron (III) citrate hydrate - Fe(III) 16.5-20% , CAS No.334024-15-6

CAS: 334024-15-6 Cat. No.: I639284 Peso molecular: 244.94(anhy) PubChem CID: 22178220

GRADE & PURITY Fe(III) 16.5-20%

Synonyms

IRON(3+) CITRATE HYDRATE | CHEBI:144434 | DTXSID50165350 | Riona | Iron(III) citrate hydrate | Q27256227 | UNII-334S8T6LKE | D10705 | Iron(III) citrate tribasic monohydrate | Ferric citrate monohydrate | AKOS025296077 | 1,2,3-Propanetricarboxylic acid, 2-

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

IRON(3+) CITRATE HYDRATE | CHEBI:144434 | DTXSID50165350 | Riona | Iron(III) citrate hydrate | Q27256227 | UNII-334S8T6LKE | D10705 | Iron(III) citrate tribasic monohydrate | Ferric citrate monohydrate | AKOS025296077 | 1, 2, 3-Propanetricarboxylic acid, 2-

Especificaciones y pureza

Fe(III) 16.5-20%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Nombres e identificadores

• Sonrisas canónicas: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[Fe+3]
• IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate;iron(3+);hydrate
• InChIKey: AJVRSHNXSHMMCH-UHFFFAOYSA-K
• INCHI: 1S/C6H8O7.Fe.H2O/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);;1H2/q;+3;/p-3
• Isómeros SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[Fe+3]
• PubChem CID: 22178220
• Peso molecular: 244.94(anhy)

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Tricarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Tricarboxylic acids and derivatives
• Alternative Parents: Tertiary alcohols Carboxylic acid salts Organic transition metal salts Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tricarboxylic acid or derivatives - Tertiary alcohol - Carboxylic acid salt - Organic transition metal salt - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Alcohol - Organic cation - Aliphatic acyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Solubilidad: Soluble in water.
• Peso molecular: 262.960 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 262.949 Da
• Monoisotopic Mass: 262.949 Da
• Topological Polar Surface Area: 142.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 211.000
• 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: 3

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