Ammonium citrate dibasic - AR, ≥98% , CAS No.3012-65-5

CAS: 3012-65-5 Cat. No.: A102864 Fórmula: C₆H₁₄N₂O₇ Peso molecular: 226.18 Beilstein Registry Number: 4925760 Número CE: 221-146-3

GRADE & PURITY AR, ≥98%

Synonyms

ammonium hydrogen citrate | Ammonium monohydrogen citrate | Citrate (diammonium) | Citric acid, diammonium salt | Dibasic ammonium citrate | citric acid diammonium salt | HSDB 300 | Microstop | Citric acid ammonium salt | DIAMMONIUM CITRATE | Ammonium cit

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

ammonium hydrogen citrate | Ammonium monohydrogen citrate | Citrate (diammonium) | Citric acid, diammonium salt | Dibasic ammonium citrate | citric acid diammonium salt | HSDB 300 | Microstop | Citric acid ammonium salt | DIAMMONIUM CITRATE | Ammonium cit

Especificações e pureza

AR, ≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Grau

AR

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 504752870
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752870
• Sorrisos canónicos: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[NH4+].[NH4+]
• IUPAC Name: diazanium;3-carboxy-3-hydroxypentanedioate
• InChIKey: YXVFQADLFFNVDS-UHFFFAOYSA-N
• INCHI: 1S/C6H8O7.2H3N/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);2*1H3
• SMILES isoméricas: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[NH4+].[NH4+]
• WGK Alemanha: 3
• RTECS: GE7545000
• Número UN: 3077
• Grupo de embalagem: III
• Peso molecular: 226.18
• Beilstein: 4925760
• Reaxy-Rn: 18034579
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18034579&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: 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 nitrogen compounds Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tricarboxylic acid or derivatives - Hydroxy acid - Alpha-hydroxy acid - Tertiary alcohol - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descrição: 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: ammonium salt - citrate salt

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

Propriedades químicas e físicas

• Sensibilidade: Moisture sensitive.
• Peso molecular: 226.180 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 226.08 Da
• Monoisotopic Mass: 226.08 Da
• Topological Polar Surface Area: 140.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 216.000
• 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

XLogP3

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What does AR mean?

AR is a defined analytical purity tier suitable for general analytical and reagent applications. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. AR is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.

How should this product be stored?

Store at room temperature.

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 3012-65-5, the molecular formula is C6H14N2O7, and the molecular weight is 226.18 g/mol. InChIKey YXVFQADLFFNVDS-UHFFFAOYSA-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.