Barium hydroxide hydrate - ≥99.5% metals basis , CAS No.40226-30-0

CAS: 40226-30-0 Cat. No.: B573482 Molecular Weight: 171.34 (anhydrous） EC Number: 628-528-2

GRADE & PURITY ≥99.5% metals basis

Synonyms

AKOS015855139 | Barium hydroxide--water (1/2/1) | MFCD00149151 | Barium hydroxide hydrate | BARIUM HYDROXIDE MONOHYDRATE [MI] | GKQTUHKAQKWLIN-UHFFFAOYSA-L | Barium hydroxide, monohydrate | Q27286031 | DTXSID80944973

Storage

Room temperature,Desiccated,Cool

Shipped In

FedEx DG Service

Specifications

Synonyms

AKOS015855139 | Barium hydroxide--water (1/2/1) | MFCD00149151 | Barium hydroxide hydrate | BARIUM HYDROXIDE MONOHYDRATE [MI] | GKQTUHKAQKWLIN-UHFFFAOYSA-L | Barium hydroxide, monohydrate | Q27286031 | DTXSID80944973

Specifications & Purity

≥99.5% metals basis

Storage

Room temperature, Desiccated, Cool

Shipped In

FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥99.5% metals basis

Names and Identifiers

• Canonical Smiles: O.[OH-].[OH-].[Ba+2]
• IUPAC Name: barium(2+);dihydroxide;hydrate
• InChIKey: GKQTUHKAQKWLIN-UHFFFAOYSA-L
• INCHI: 1S/Ba.3H2O/h;3*1H2/q+2;;;/p-2
• Isomeric SMILES: O.[OH-].[OH-].[Ba+2]
• WGK Germany: 3
• UN Number: 3262
• Packing Group: II
• Molecular Weight: 171.34 (anhydrous）
• Reaxy-Rn: 14627681
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14627681&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Inorganic compounds
  • Superclass Mixed metal/non-metal compounds
    • Class Alkaline earth metal oxoanionic compounds
      • Subclass Alkaline earth metal hydroxides

• Kingdom: Inorganic compounds
• Superclass: Mixed metal/non-metal compounds
• Class: Alkaline earth metal oxoanionic compounds
• Subclass: Alkaline earth metal hydroxides
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkaline earth metal hydroxides
• Alternative Parents: Inorganic salts Inorganic oxides Inorganic hydrides
• Molecular Framework: Not available
• Substituents: Alkaline earth metal hydroxide - Inorganic hydride - Inorganic oxide - Inorganic salt
• Description: This compound belongs to the class of inorganic compounds known as alkaline earth metal hydroxides. These are inorganic compounds in which the largest oxoanion is hydroxide, and in which the heaviest atom not in an oxoanion is an alkaline earth metal.
• 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

Chemical and Physical Properties

• Sensitivity: Sensitive to air
• Melt Point(°C): 78 °C(lit.)
• Molecular Weight: 189.360 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 189.921 Da
• Monoisotopic Mass: 189.921 Da
• Topological Polar Surface Area: 3.000 Ų
• Heavy Atom Count: 4
• 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: 4

XLogP3

References

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2. Cheng Chen, Dehong Yu, Wandong Wang, Yuqi Huang, Yu Ying, Weiwei Sheng, Xiunan Wu, Yun Wang, Fenglei Gao, Guan Jiang.  (2023)  Hyaluronic acid-covered piezoelectric nanocomposites as tumor microenvironment modulators for piezoelectric catalytic therapy of melanoma.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:36921829] [10.1016/j.ijbiomac.2023.124020]

3. Yanming Liu, Xinyu Wang, Yiming Qiao, Mengdie Min, Liren Wang, Hao Shan, Yanling Ma, Wei Hao, Peng Tao, Wen Shang, Jianbo Wu, Chengyi Song, Tao Deng.  (2018)  Pyroelectric Synthesis of Metal–BaTiO3 Hybrid Nanoparticles with Enhanced Pyrocatalytic Performance.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.8b05647]

4. Guoxue Liu, Wei Li, Ran Bi, Christian Atangana Etogo, Xin-Yao Yu, Lei Zhang.  (2018)  Cation-Assisted Formation of Porous TiO2–x Nanoboxes with High Grain Boundary Density as Efficient Electrocatalysts for Lithium–Oxygen Batteries.  ACS Catalysis,      [PMID:] [10.1021/acscatal.7b04182]

5. Junyan Chen, Meilin Li, Qingtao Zhu, Lei Xiao, Xue Tang, Lijun Zhou, Xianfen Chen, Jiabin Chen, Zhigao Liu, Quanping Yuan.  (2024)  Flexible BTO piezoelectric generator fabricated by hydrothermal method with the assistance of lignocellulose and carbon nanomaterials.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.154742]