Sodium 3-bromobenzenesulfinate - ≥90% , CAS No.89520-70-7

CAS: 89520-70-7 Cat. No.: S590609 Peso molecular: 243.06 Número EC: 999-996-6 PubChem CID: 23717249

GRADE & PURITY ≥90%

Synonyms

3-Bromobenzenesulfinic acid sodium salt | AS-82209 | Sodium 3-bromobenzenesulfinate | DTXSID10635802 | EN300-225947 | C6H4BrNaO2S | E79223 | Benzenesulfinic acid, 3-bromo-, sodium salt | SCHEMBL7515941 | MFCD11618015 | sodium;3-bromobenzenesulfinate | Sod

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

3-Bromobenzenesulfinic acid sodium salt | AS-82209 | Sodium 3-bromobenzenesulfinate | DTXSID10635802 | EN300-225947 | C6H4BrNaO2S | E79223 | Benzenesulfinic acid, 3-bromo-, sodium salt | SCHEMBL7515941 | MFCD11618015 | sodium;3-bromobenzenesulfinate | Sod

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥90%

Nombres e identificadores

• Sonrisas canónicas: C1=CC(=CC(=C1)Br)S(=O)[O-].[Na+]
• IUPAC Name: sodium;3-bromobenzenesulfinate
• InChIKey: LMRDXRGLFWAOLS-UHFFFAOYSA-M
• INCHI: 1S/C6H5BrO2S.Na/c7-5-2-1-3-6(4-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1
• Isómeros SMILES: C1=CC(=CC(=C1)Br)S(=O)[O-].[Na+]
• PubChem CID: 23717249
• Peso molecular: 243.06

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Bromobenzenes
• Alternative Parents: Aryl bromides Sulfinic acids and derivatives Organic metal halides Organosulfur compounds Organobromides Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl bromide - Aryl halide - Sulfinic acid derivative - Organic metal halide - Organic alkali metal salt - Organic oxygen compound - Organic oxide - Organic salt - Organic sodium salt - Organosulfur compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
• 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

• Peso molecular: 243.060 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 241.901 Da
• Monoisotopic Mass: 241.901 Da
• Topological Polar Surface Area: 59.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 145.000
• 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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