Sodium bromide - anhydrous, high-purity, Reagent grade, ≥99% , CAS No.7647-15-6

CAS: 7647-15-6 Cat. No.: S433756 Formula: NaBr Molecular Weight: 102.89 Beilstein Registry Number: 3587179 EC Number: 231-599-9 PubChem CID: 253881

GRADE & PURITY Anhydrous Grade, Reagent Grade, High-purity, ≥99%

Synonyms

DTXSID3034903 | SODIUM BROMIDE (USP MONOGRAPH) | Sodium bromide, Vetec(TM) reagent grade, 98% | Trisodium tribromide | WLN: NA E | NSC 77384; Sanibrom 40 | AKOS030254307 | EINECS 231-599-9 | Caswell No. 750A | (2S,3S,4R)-2-Carboxy-4-isopropyl-3-pyrrolidin

Storage

Room temperature

Overview

Application

Co-catalyst for TEMPO/NaOCl oxidation of alcohols in non-chlorinated solvents. Towards greener solvents for the bleach oxidation of alcohols catalysed by stable N-oxy radicals

Specifications

Synonyms

DTXSID3034903 | SODIUM BROMIDE (USP MONOGRAPH) | Sodium bromide, Vetec(TM) reagent grade, 98% | Trisodium tribromide | WLN: NA E | NSC 77384; Sanibrom 40 | AKOS030254307 | EINECS 231-599-9 | Caswell No. 750A | (2S,3S,4R)-2-Carboxy-4-isopropyl-3-pyrrolidin

Specifications & Purity

anhydrous, high-purity, Reagent grade, ≥99%

Storage

Room temperature

Grade

Anhydrous Grade, High-purity, Reagent Grade

Purity

≥99%

Names and Identifiers

Pubchem Sid

528773002

Canonical Smiles

[Na+].[Br-]

IUPAC Name

sodium;bromide

InChIKey

JHJLBTNAGRQEKS-UHFFFAOYSA-M

INCHI

1S/BrH.Na/h1H;/q;+1/p-1

Isomeric SMILES

[Na+].[Br-]

RTECS

VZ3150000

PubChem CID

253881

Molecular Weight

102.89

Beilstein

3587179

Taxonomic Classification

Taxonomy Tree

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

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

Associated Targets(Human)

CA2 Tclin Carbonic anhydrase II (17698 Activities)

Discover Target: CA2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CA1 Tclin Carbonic anhydrase I (13240 Activities)

Discover Target: CA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Carbonic anhydrase (69 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Trypanosoma cruzi (99888 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Refractive Index: 1.64
• Boil Point(°C): 1390°C
• Melt Point(°C): 755°C
• Molecular Weight: 102.890 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 101.908 Da
• Monoisotopic Mass: 101.908 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 2
• Formal Charge: 0
• Complexity: 2.000
• 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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