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3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide | CAS No. 1191252-49-9

3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide

Basic Information

Chemical_Structure_Of
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CAS Number

1191252-49-9

Molecular Formula

C22H15Br2N3O4

Molecular Weight

545.19 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Ethers
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Dyes and Pigments Organic Dyes
Fine Chemicals Surfactants Anionic Surfactants
Agricultural Chemicals Pesticides Herbicides
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Solubility

Insuluble (1.6E-4 g/L) (25 ºC),

SMILES

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C1=CC=C(C=C1)OC2=CC=C(C=C2)CNC(=O)C3=NC(=NO3)C4=CC(=C(C(=C4)Br)O)Br

InChI

InChI=1S/C22H15Br2N3O4/c23-17-10-14(11-18(24)19(17)28)20-26-22(31-27-20)21(29)25-12-13-6-8-16(9-7-13)30-15-4-2-1-3-5-15/h1-11,28H,12H2,(H,25,29)

InChIKey

DSFNLJXHXBIKDS-UHFFFAOYSA-N

LogP

5.689500000000003

Topological Polar Surface Area

97.48 Ų

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

575

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • IOWH-032
  • IOWH032
  • 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
  • 3-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)-N-[(4-phenoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
  • S7329
  • UNII-8Y3GDT6YWV
  • C22H15Br2N3O4
  • CCG-269979
  • NS00072893
  • 1191252-49-9
  • MFCD25977119
  • SW219782-1
  • CS-1744
  • NCGC00386303-01
  • 3-(3,5-dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide .
  • AC-32675
  • iOWH-032
  • 1,2,4-Oxadiazole-5-carboxamide, 3-(3,5-dibromo-4-hydroxyphenyl)-N-[(4-phenoxyphenyl)methyl]-
  • AS-74457
  • 1,2,4-OXADIAZOLE-5-CARBOXAMIDE, 3-(3,5-DIBROMO-4-HYDROXYPHENYL)-N-((4-PHENOXYPHENYL)METHYL)-
  • NCGC00386303-02
  • EX-A327
  • AKOS026750509
  • PD056071
  • SB17367
  • SCHEMBL1114552
  • HY-18337
  • Q27271180
  • s7329
  • 3-(3,5-DIBROMO-4-HYDROXYPHENYL)-N-[(4-PHENOXYPHENYL)METHYL]-1,2,4-OXADIAZOLE-5-CARBOXAMIDE
  • 8Y3GDT6YWV

MDL Number

MFCD28978033

FAQ

What regulatory guidelines apply to 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9)?
3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9) is subject to various regulatory guidelines including GHS classification for hazardous chemicals, REACH regulations in the European Union for chemical safety, and FDA/EPA requirements for safety and environmental impact assessments. Compliance with these guidelines ensures safe handling, storage, and disposal of the compound.

Are there alternatives to 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide in synthesis?
While 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9) is a specific compound, alternative reagents such as other oxadiazoles or brominated phenols can be used depending on the desired application. These alternatives may offer similar functionalities or improved synthesis conditions, reducing the need for this specific compound in certain scenarios.

What is the market or research trend for 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9)?
The research trend for 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9) reflects increasing interest in novel chemical structures for pharmaceutical and materials science applications. Market demand is driven by advancements in drug discovery and the development of advanced materials, with a focus on sustainability and reduced environmental impact.

How should waste containing 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9) be handled?
Waste containing 3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide (CAS: 1191252-49-9) should be collected in appropriate containers and stored under controlled conditions to prevent environmental contamination. Proper disposal methods include incineration or professional waste disposal services that adhere to local and international regulations. Safe handling and disposal procedures must be followed to ensure environmental protection and compliance with regulatory requirements.

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3-(3,5-Dibromo-4-hydroxyphenyl)-N-(4-phenoxybenzyl)-1,2,4-oxadiazole-5-carboxamide — Shanghai Ruhui Chemical Technology Co., Ltd.

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