Calcium oxalate hydrate - CP, ≥98% , CAS No.24804-31-7

CAS: 24804-31-7 Cat. No.: C104249 Peso molecular: 128.10(anhydrous basis) Número EC: 684-189-0

GRADE & PURITY CP, ≥98%

Synonyms

AKOS015916111 | UNII-4PP86KK527 | DTXSID50973513 | N-UNDECYLETHER | 4PP86KK527 | Calcium oxalate hydrate | Ethanedioic acid, calcium salt (1:1), monohydrate | Q27260343 | Calcium ethanedioate--water (1/1/1) | Ethanedioic acid, calcium salt, hydrate (1:1:1

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AKOS015916111 | UNII-4PP86KK527 | DTXSID50973513 | N-UNDECYLETHER | 4PP86KK527 | Calcium oxalate hydrate | Ethanedioic acid, calcium salt (1:1), monohydrate | Q27260343 | Calcium ethanedioate--water (1/1/1) | Ethanedioic acid, calcium salt, hydrate (1:1:1

Especificaciones y pureza

CP, ≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

CP

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504757570
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757570
• Sonrisas canónicas: C(=O)(C(=O)[O-])[O-].O.[Ca+2]
• IUPAC Name: calcium;oxalate;hydrate
• InChIKey: LQHWSGSWNOHVHO-UHFFFAOYSA-L
• INCHI: 1S/C2H2O4.Ca.H2O/c3-1(4)2(5)6;;/h(H,3,4)(H,5,6);;1H2/q;+2;/p-2
• Isómeros SMILES: C(=O)(C(=O)[O-])[O-].O.[Ca+2]
• WGK Alemania: 3
• CAS alternativo: 563-72-4
• Peso molecular: 128.10(anhydrous basis)
• Reaxy-Rn: 3757668
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3757668&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Carboxylic acid salts Organic calcium salts Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Carboxylic acid salt - Organic calcium salt - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid 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

• Sensibilidad: Hygroscopic
• Peso molecular: 146.110 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 145.953 Da
• Monoisotopic Mass: 145.953 Da
• Topological Polar Surface Area: 81.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 60.500
• 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: 3

XLogP3