Calcium bromide - PrimorTrace™, Ultra dry, ≥99.99% metals basis , CAS No.7789-41-5

CAS: 7789-41-5 Cat. No.: C283864 Formula: Br₂Ca Molecular Weight: 199.89 EC Number: 232-164-6

GRADE & PURITY PrimorTrace™, Ultra dry, ≥99.99% metals basis

Synonyms

7789-41-5|Calcium bromide|Calcium dibromide|Calciumbromide|Kalziumbromid|CaBr2|CHEBI:31338|87CNY2EEBH|DTXSID0044577|DTXCID8024577|Brocal|CHEMBL2105852|WGEFECGEFUFIQW-UHFFFAOYSA-L|AKOS015832992|H-PRO-PNAHBR|CALCIUMBROMIDEDIHYDRATE|CALCIUM BROMIDE [MI]|CALC

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

CaBr2 is mainly used as a dense aqueous solution for drilling fluid. It is also used in neuroses medication, freezing mixtures, food preservatives, photography and fire retardants.

Specifications

Synonyms

7789-41-5 | Calcium bromide | Calcium dibromide | Calciumbromide | Kalziumbromid | CaBr2 | CHEBI:31338 | 87CNY2EEBH | DTXSID0044577 | DTXCID8024577 | Brocal | CHEMBL2105852 | WGEFECGEFUFIQW-UHFFFAOYSA-L | AKOS015832992 | H-PRO-PNAHBR | CALCIUMBROMIDEDIHYDRATE | CALCIUM BROMIDE [MI] | CALC

Specifications & Purity

PrimorTrace™, Ultra dry, ≥99.99% metals basis

Storage

Room temperature,Argon charged

Shipped In

Normal

Grade

PrimorTrace™, Ultra dry

Purity

≥99.99% metals basis

Names and Identifiers

Pubchem Sid

528773001

Canonical Smiles

[Ca+2].[Br-].[Br-]

IUPAC Name

calcium;dibromide

InChIKey

WGEFECGEFUFIQW-UHFFFAOYSA-L

INCHI

1S/2BrH.Ca/h2*1H;/q;;+2/p-2

Isomeric SMILES

[Ca+2].[Br-].[Br-]

WGK Germany

1

Molecular Weight

199.89

Taxonomic Classification

Taxonomy Tree

• Kingdom Inorganic compounds
  • Superclass Mixed metal/non-metal compounds
    • Class Alkaline earth metal salts
      • Subclass Alkaline earth metal bromides

• Kingdom: Inorganic compounds
• Superclass: Mixed metal/non-metal compounds
• Class: Alkaline earth metal salts
• Subclass: Alkaline earth metal bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkaline earth metal bromides
• Alternative Parents: Inorganic calcium salts
• Molecular Framework: Not available
• Substituents: Alkaline earth metal bromide - Inorganic calcium salt - Inorganic salt
• Description: This compound belongs to the class of inorganic compounds known as alkaline earth metal bromides. These are inorganic compounds in which the largest halogen atom is Bromine, and the heaviest metal atom a lanthanide.
• External Descriptors: calcium 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

Chemical and Physical Properties

• Solubility: It is soluble in water, alcohol and acetone.
• Sensitivity: Hygroscopic. Ambient temperatures.
• Boil Point(°C): 806-812°
• Melt Point(°C): 730°
• Molecular Weight: 199.890 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 199.797 Da
• Monoisotopic Mass: 197.799 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 3
• Formal Charge: 0
• Complexity: 0.000
• 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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