Tetraphenylarsonium chloride hydrochloride hydrate - ≥97% , CAS No.123334-18-9

CAS: 123334-18-9 Cat. No.: T101240 Peso molecular: 455.25 (anhydrous basis) Número EC: 621-302-4 PubChem CID: 16211271

GRADE & PURITY ≥97%

Synonyms

Tetraphenylarsonium(V) chloride hydrochloride hydrate

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

Tetraphenylarsonium(V) chloride hydrochloride hydrate

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488199090
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488199090
• Sonrisas canónicas: C1=CC=C(C=C1)[As+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl.[Cl-]
• IUPAC Name: tetraphenylarsanium;chloride;hydrate;hydrochloride
• InChIKey: HRCBNZHNCWEFFR-UHFFFAOYSA-M
• INCHI: 1S/C24H20As.2ClH.H2O/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;;;/h1-20H;2*1H;1H2/q+1;;;/p-1
• Isómeros SMILES: C1=CC=C(C=C1)[As+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.O.Cl.[Cl-]
• WGK Alemania: 3
• PubChem CID: 16211271
• Número ONU: 3077
• Peso molecular: 455.25 (anhydrous basis)
• Reaxy-Rn: 5212590

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Tetraorganoarsonium salts Oxygen-containing organoarsenic compounds Organic metalloid salts Organopnictogen compounds Organic oxides Organic chloride salts Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Tetraorganoarsonium salt - Monocyclic benzene moiety - Oxygen-containing organoarsenic compound - Organic metalloid salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Hydrochloride - Organic salt - Organoarsenic compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• 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

• Solubilidad: Soluble in water
• Punto de fusión (°C): 211-213°C
• Peso molecular: 473.300 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 472.034 Da
• Monoisotopic Mass: 472.034 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 301.000
• 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

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