3,5-Dibromophenol - ≥98%(GC) , CAS No.626-41-5

CAS: 626-41-5 Cat. No.: D139101 Molecular Weight: 251.91 Beilstein Registry Number: 6(4)1065 EC Number: 629-188-8

GRADE & PURITY ≥98%(GC)

Synonyms

AM20040895 | FT-0612051 | 3,5-Dibromphenol | A8659 | DTXSID70211646 | EN300-113704 | TD1260 | MFCD06411376 | BCP05888 | SY012996 | D3820 | J-511271 | SCHEMBL309955 | AKOS005068134 | GS-3389 | 3,5-Dibromophenol, 97% | PZFMWYNHJFZBPO-UHFFFAOYSA-N | HY-W0079

Storage

Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Overview

Product Application：

3,5-Dibromophenol is used as a pharmaceutical intermediate. It is also used to prepare aromatic polyesters and drugs for arthritis.

Specifications

Synonyms

AM20040895 | FT-0612051 | 3, 5-Dibromphenol | A8659 | DTXSID70211646 | EN300-113704 | TD1260 | MFCD06411376 | BCP05888 | SY012996 | D3820 | J-511271 | SCHEMBL309955 | AKOS005068134 | GS-3389 | 3, 5-Dibromophenol, 97% | PZFMWYNHJFZBPO-UHFFFAOYSA-N | HY-W0079

Specifications & Purity

≥98%(GC)

Biochemical and Physiological Mechanisms

Cuminaldehyde increases the insulin secretion in streptozotocin-induced diabetic rats. It suppresses melanin formation in cultured murine B16-F10 melanoma cells.

Storage

Room temperature, Argon charged, Desiccated, Cool

Shipped In

Normal

Purity

≥98%(GC)

Names and Identifiers

• Pubchem Sid: 504752296
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752296
• Canonical Smiles: C1=C(C=C(C=C1Br)Br)O
• IUPAC Name: 3,5-dibromophenol
• InChIKey: PZFMWYNHJFZBPO-UHFFFAOYSA-N
• INCHI: 1S/C6H4Br2O/c7-4-1-5(8)3-6(9)2-4/h1-3,9H
• Isomeric SMILES: C1=C(C=C(C=C1Br)Br)O
• WGK Germany: 3
• UN Number: 2811
• Packing Group: III
• Molecular Weight: 251.91
• Beilstein: 6(4)1065
• Reaxy-Rn: 2432916
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2432916&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Phenols
      • Subclass Halophenols
        • Level5 Bromophenols
          • Level6 M-bromophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Bromophenols
• Direct Parent: M-bromophenols
• Alternative Parents: Bromobenzenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 3-bromophenol - 1-hydroxy-4-unsubstituted benzenoid - 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
• Description: This compound belongs to the class of organic compounds known as m-bromophenols. These are bromophenols carrying a iodine at the C3 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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Sightly soluble in water. Soluble in methanol.
• Sensitivity: Air sensitive;light sensitive
• Boil Point(°C): 122 °C
• Melt Point(°C): 79.0 - 83.0 °C
• Molecular Weight: 251.900 g/mol
• XLogP3: 3.500
• 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: 87.100
• 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

References

1. Hao Zheng, Jiangbangrui Chu, Shikang Li, Xun Tang, Shicheng Bi, Kerong Chen, Anwei Zhou, Youwen Yang, Xinghai Ning, Yurui Xu.  (2025)  An Optimized Aerogel-Based Apheresis Device for Targeted Lipid Clearance in Elderly Hyperlipidemia Patients.  ADVANCED MATERIALS,      [PMID:40255169] [10.1002/adma.202420091]