Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate | CAS No. 123343-16-8

Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate

Basic Information

CAS Number

123343-16-8

Molecular Formula

C13H10ClN2NaO4S

Molecular Weight

348.74 g/mol

AD

Basic Physical Properties

Melting Point

233-234 ºC

Water Solubility

705 g/L (pH7)

Flash Point

234°C

COc1cc(nc(n1)Sc2cccc(c2C(=O)[O-])Cl)OC.[Na+]

InChI

InChI=1S/C13H11ClN2O4S.Na/c1-19-9-6-10(20-2)16-13(15-9)21-8-5-3-4-7(14)11(8)12(17)18;/h3-6H,1-2H3,(H,17,18);/q;+1/p-1

InChIKey

CNILNQMBAHKMFS-UHFFFAOYSA-M

LogP

1.66190

Complexity

357

Safety Information

View Safety Information

Toxicity

LD50 in male, female rats (mg/kg): 1000-3000, 3000-5000 orally; LD50 in rats (mg/kg): >2000 dermally (Takahashi)

Synonyms & References

English

  • Pyrithiobac-sodium
  • 2-Chloro-6-{(4,6-dimethoxy-2-pyrimidinyl)thio}benzoic acid sodium salt
  • Sodium 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio)benzoate
  • Pyrithiobac sodium salt
  • DPX-PE350
  • KIH 2031
  • Staple
  • Pyrithiobac-Sodium Solution
  • sodium,2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)sulfanylbenzoate
  • Pyrithiobac-sodium [ISO]
  • Sodium 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio0benzoate
  • Sodium 2-chloro-6-(4,6-dimethoxypyrimidin-2-ylthio)benzoate
  • sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)thio]benzoate
  • sodium 2-chloro-6-[(4,6-dimethoxypyrimidin-2-yl)sulfanyl]benzoate
  • Staple 85SP
  • Pyrithiobac sodium
  • 5M13LUJ9WY
  • Benzoic acid, 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio)-, sodiu, salt
  • Benzoic acid, 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)thio]-, sodium salt
  • S

MDL Number

MFCD04112620

FAQ

What regulatory guidelines apply to Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8)?

Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) is subject to various regulatory guidelines. The European Union REACH regulation requires manufacturers and importers to register substances above a certain tonnage. Additionally, it must comply with the Globally Harmonized System (GHS) for classification and labeling under CLP regulations. The FDA and EPA may also have specific requirements for its handling and use in the United States, particularly concerning environmental protection and human health.

Are there alternatives to Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) in synthesis?

Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) can be synthesized using alternative reagents such as other chlorobenzoates or sulfonamides. Common alternatives include sodium 2-chloro-5-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate, which can serve as a similar reagent in various chemical reactions. These alternatives may offer different reactivity profiles and may be used depending on the specific chemical process requirements.

What is the market or research trend for Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8)?

The market trend for Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) indicates an increasing interest in its application in pharmaceutical and agrochemical industries due to its unique chemical properties. Research is focusing on its use as a key intermediate in the synthesis of biologically active compounds. Price trends suggest a steady demand with minor fluctuations based on supply and demand dynamics. Emerging research areas include its potential in antifungal and antimicrobial applications, driving market growth.

How should waste containing Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) be handled?

Waste containing Sodium 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)sulfanyl]benzoate (CAS: 123343-16-8) should be managed in accordance with local and national regulations. It is recommended to collect waste in appropriate containers and store it in a secure location. For disposal, professional waste management services should be utilized to ensure safe incineration or chemical treatment. Environmental protection measures include ensuring no contamination of soil or water sources. Compliance with regulatory requirements, such as the EU Waste Framework Directive, is crucial for proper waste management.

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