2,4-Dibromophenol - ≥97%(GC) , CAS No.615-58-7

CAS: 615-58-7 Cat. No.: D133947 분자식: C₆H₄Br₂O 분자량: 251.91 Beilstein Registry Number: 6(4)1061 EC 번호: 210-436-5

등급 & 순도 ≥97%(GC)

Synonyms

2,4-Dibromophenol 100 microg/mL in Methanol | Y8I | AKOS000118746 | Emery 9331 | IA75T5C9TG | AC-17043 | BDBM50150792 | Phenol, 2,4-dibromo-; 2,4-Dibromophenol; NSC 5723; NSC 6213 | 2,4-Dibromophenol, analytical standard | BP-11833 | Phenol,4-dibromo- | A

Storage

Store at 2-8°C

Shipped In

Wet ice

개요

The electrochemical hydrodehalogenation of 2,4-dibromophenol has been studied by electrochemical reduction in H-cells and solid polymer electrolyte cells using catalyzed cathodes. 2,4-Dibromophenol inhibits the microbial activity in marine sediments.

사양

동의어

2,4-Dibromophenol 100 microg/mL in Methanol | Y8I | AKOS000118746 | Emery 9331 | IA75T5C9TG | AC-17043 | BDBM50150792 | Phenol, 2,4-dibromo-; 2,4-Dibromophenol; NSC 5723; NSC 6213 | 2,4-Dibromophenol, analytical standard | BP-11833 | Phenol,4-dibromo- | A

사양 및 순도

≥97%(GC)

보관 조건

Store at 2-8°C

배송

Wet ice

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순수함

≥97%(GC)

이름과 식별자

Pubchem Sid

504752237

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752237

정식 스마일

C1=CC(=C(C=C1Br)Br)O

IUPAC Name

2,4-dibromophenol

InChIKey

FAXWFCTVSHEODL-UHFFFAOYSA-N

INCHI

1S/C6H4Br2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

이성체 SMILES

C1=CC(=C(C=C1Br)Br)O

WGK 독일

3

RTECS

SK8010000

UN 번호

2811

포장 그룹

II

분자량

251.91

Beilstein

6(4)1061

Reaxy-Rn

1861291

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1861291&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Bromophenols
• Direct Parent: P-bromophenols
• Alternative Parents: O-bromophenols Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 4-bromophenol - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Bromobenzene - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• 설명: 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: bromophenol

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

관련 대상(인간)

ALOX12 Tchem Arachidonate 12-lipoxygenase (3262 Activities)

Discover Target: ALOX12

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALOX15 Tchem Arachidonate 15-lipoxygenase (7108 Activities)

Discover Target: ALOX15

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 용해성: Solubility in water: Practically insoluble; Soluble in Methanol
• 발화점(°F): 235.4 °F
• 발화점(°C): 113 °C
• 끓는점(°C): 239 °C
• 녹는점(°C): 39 °C
• 분자량: 251.900 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 251.861 Da
• Monoisotopic Mass: 249.863 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• 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