2,4-Dibromo-6-chlorophenol - ≥98% , CAS No.4526-56-1

CAS: 4526-56-1 Cat. No.: C170427 Formule: C₆H₃Br₂ClO Poids moléculaire: 286.351 Numéro CE: 620-945-8

GRADE & PURITY ≥98%

Synonyms

AB92883 | Phenol, 2,4-dibromo-6-chloro- | 2-chloro-4,6-dibromophenol | DTXSID40196456 | E89348 | AKOS024336179 | SCHEMBL4644670 | 2,4-Dibromo-6-chlorophenol | MFCD00029692

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

AB92883 | Phenol, 2,4-dibromo-6-chloro- | 2-chloro-4,6-dibromophenol | DTXSID40196456 | E89348 | AKOS024336179 | SCHEMBL4644670 | 2,4-Dibromo-6-chlorophenol | MFCD00029692

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

504752993

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752993

Sourires canoniques

C1=C(C=C(C(=C1Cl)O)Br)Br

IUPAC Name

2,4-dibromo-6-chlorophenol

InChIKey

MQSIWVCWTVYFDP-UHFFFAOYSA-N

INCHI

1S/C6H3Br2ClO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H

Isomères SMILES

C1=C(C=C(C(=C1Cl)O)Br)Br

Poids moléculaire

286.351

Reaxy-Rn

2253423

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2253423&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass Halophenols
        • Level5 Bromophenols
          • Level6 P-bromophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Bromophenols
• Direct Parent: P-bromophenols
• Alternative Parents: O-chlorophenols O-bromophenols Chlorobenzenes Bromobenzenes Aryl chlorides Aryl bromides Organooxygen compounds Organochlorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 4-bromophenol - 2-bromophenol - 2-chlorophenol - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organochloride - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as p-bromophenols. These are bromophenols carrying a iodine at the C4 position of the 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

Propriétés chimiques et physiques

• Poids moléculaire: 286.350 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 285.822 Da
• Monoisotopic Mass: 283.824 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 122.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 4526-56-1, the molecular formula is C6H3Br2ClO, and the molecular weight is 286.351 g/mol. InChIKey MQSIWVCWTVYFDP-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.