2-Bromo-5-hydroxybenzaldehyde - ≥95% , CAS No.2973-80-0

CAS: 2973-80-0 Cat. No.: B135432 Fórmula: C₇H₅BrO₂ Peso molecular: 201.02 Número CE: 608-410-7

GRADE & PURITY ≥95%

Synonyms

5-Hydroxy-2-Bromobenzaldehyde | Benzaldehyde, 2-bromo-5-hydroxy- | N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]thiaxanthene-2-sulfonamide | SCRQAWQJSSKCFN-UHFFFAOYSA-N | PS-4859 | Z1269171271 | DTXSID7049265 | 4-Bromo-3-formylphenol | 5R-1532 |

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

5-Hydroxy-2-Bromobenzaldehyde | Benzaldehyde, 2-bromo-5-hydroxy- | N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]thiaxanthene-2-sulfonamide | SCRQAWQJSSKCFN-UHFFFAOYSA-N | PS-4859 | Z1269171271 | DTXSID7049265 | 4-Bromo-3-formylphenol | 5R-1532 |

Especificações e pureza

≥95%

Condições de armazenamento de armazenamento

Argon charged,Room temperature

Enviado em

Normal

Pureza

≥95%

Nomes e identificadores

• Pubchem Sid: 488189665
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488189665
• Sorrisos canónicos: C1=CC(=C(C=C1O)C=O)Br
• IUPAC Name: 2-bromo-5-hydroxybenzaldehyde
• InChIKey: SCRQAWQJSSKCFN-UHFFFAOYSA-N
• INCHI: 1S/C7H5BrO2/c8-7-2-1-6(10)3-5(7)4-9/h1-4,10H
• SMILES isoméricas: C1=CC(=C(C=C1O)C=O)Br
• WGK Alemanha: 3
• CAS alternativo: 1761-61-1,2973-80-0
• Número NSC: 680715
• Peso molecular: 201.02
• Reaxy-Rn: 2079921
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2079921&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Aryl-aldehydes
            • Level7 Benzaldehydes
              • Level8 Hydroxybenzaldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes - Aryl-aldehydes - Benzaldehydes
• Direct Parent: Hydroxybenzaldehydes
• Alternative Parents: P-bromophenols Benzoyl derivatives Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Vinylogous halides Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Hydroxybenzaldehyde - 4-bromophenol - Benzoyl - 4-halophenol - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous halide - Organobromide - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as hydroxybenzaldehydes. These are organic aromatic compounds containing a benzene ring carrying an aldehyde group and a hydroxyl group.
• 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

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in chloroform, dichloromethane and ethyl acetate.
• Sensibilidade: Air Sensitive
• Ponto de fusão (°C): 132 °C
• Peso molecular: 201.020 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 199.947 Da
• Monoisotopic Mass: 199.947 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 127.000
• 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: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2973-80-0, the molecular formula is C7H5BrO2, and the molecular weight is 201.02 g/mol. InChIKey SCRQAWQJSSKCFN-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.