structure of Saflufenacil

Saflufenacil

CAS No.: 372137-35-4
M. Wt: 500.85200
M. Fa: C17H17ClF4N4O5S
InChI Key: -

Names and Identifiers of Saflufenacil

CAS Number

372137-35-4

IUPAC Name

2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]-N-[methyl(propan-2-yl)sulfamoyl]benzamide

Canonical SMILES

CC(C)N(C)S(=O)(=O)NC(=O)C1=CC(=C(C=C1Cl)F)N2C(=O)C=C(N(C2=O)C)C(F)(F)F

Physical and chemical properties of Saflufenacil

Acidity coefficient

4.24±0.40(Predicted)

BRN

11326826

Density

1.542g/cm3

Exact Mass

500.05400

Index of Refraction

1.56

LogP

3.31790

Melting Point

189.9-193.4 °C

Molecular Formula

C17H17ClF4N4O5S

Molecular Weight

500.85200

PSA

122.35000

Safety Information of Saflufenacil

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of Saflufenacil

Saflufenacil is widely utilized in agriculture for its effectiveness against broadleaf weeds. It is registered for use in various crops, including:

  • Soybeans
  • Corn
  • Fruit trees
  • Nut trees
  • Vineyards

The application methods include pre-plant and pre-emergence treatments, as well as desiccation prior to harvest . Annual usage estimates indicate significant application rates, particularly in corn and soybean cultivation .

Interaction Studies of Saflufenacil

Research indicates that saflufenacil has low acute toxicity through oral, dermal, and inhalation routes . In metabolism studies involving rats, it was found that the compound is well absorbed and rapidly excreted, with significant differences noted between male and female rats regarding excretion pathways . The primary metabolites identified include M800H01, M800H03, and M800H07, which are crucial for understanding its safety profile and environmental impact .

Biological Activity of Saflufenacil

As a herbicide, saflufenacil exhibits potent biological activity against a range of broadleaf weeds. It acts by accumulating protoporphyrin IX, which is a photosensitizer that activates oxygen, leading to lipid peroxidation and cell membrane damage . This mechanism results in visible symptoms such as chlorosis and necrosis in susceptible plants while showing selectivity in crops like corn and soybeans, where it causes minimal damage .

Retrosynthesis analysis of Saflufenacil

  • Route#1

    Cas:121303-76-2
    Cas:685568-56-3
    Cas:372137-35-4
  • Route#2

    Cas:121303-76-2
    Cas:372137-35-4
  • Route#3

    Cas:507448-65-9
    Cas:685568-56-3
    Cas:372137-35-4