Prosulfuron

Base Information

• Chemical Name: Prosulfuron
• CAS No.: 94125-34-5
• Molecular Formula: C15H16F3N5O4S
• Molecular Weight: 419.384
• European Community (EC) Number: 619-000-2
• UNII: NG7LE47J14
• DSSTox Substance ID: DTXSID9034868
• Nikkaji Number: J653.647F
• Wikidata: Q22808801
• Metabolomics Workbench ID: 67993
• ChEMBL ID: CHEMBL2251587
• Mol file: 94125-34-5.mol

Synonyms:prosulfuron

Chemical Property of Prosulfuron

Chemical Property:

• Melting Point: 155° (dec)
• Refractive Index: 1.547
• PKA: 4.30±0.10(Predicted)
• PSA: 131.55000
• Density: 1.462 g/cm³
• LogP: 3.73860
• Storage Temp.: 0-6°C
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 6
• Exact Mass: 419.08750967
• Heavy Atom Count: 28
• Complexity: 628

Purity/Quality:

98%,99%, ^*data from raw suppliers

Prosulfuron ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,N
• Hazard Codes: Xn,N
• Statements: 22-50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2CCC(F)(F)F
• Uses: Herbicide.

Technology Process of Prosulfuron

There total 1 articles about Prosulfuron which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ prosulfuron (94125-34-5)

Guidance literature:

Reference yield: 14.0%

prosulfuron (94125-34-5) → 2-(3,3,3-Trifluoropropyl)benzenesulfonamide (94125-42-5) + 1-(4'-methoxy-6'-methyltriazin-2'-yl)-3{[2''-(3''',3''',3'''-trifluoropropyl)-3''-hydroxyphenyl]sulfonyl}urea + 1-(4'-methoxy-6'-methyltriazin-2'-yl)-3-{[2''-(1'''-hydroxy-3''',3''',3'''-trifluoropropyl)phenyl]sulfonyl}urea + 1-(4'-methoxy-6'-methyltriazin-2'-yl)-3-{[2''-(3''',3''',3'''-trifluoropropyl)-3'',4''-dihydroxyphenyl]sulfonyl}urea + 1-(4-hydroxy-6-methyl-1,3,5-triazin-2-yl)-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea + 1-[4-(hydroxymethyl)-6-methoxy-1,3,5-triazin-2-yl]-3-[2-(3,3,3-trifluoropropyl)phenylsulfonyl]urea

Guidance literature:

With Streptomyces griseolus (ATCC 11796); In N,N-dimethyl-formamide; for 72h; Product distribution; other microorganisms; metabolism;

DOI:10.1021/jf9604495

Reference yield:

prosulfuron (94125-34-5) → 2-(3,3,3-Trifluoropropyl)benzenesulfonamide (94125-42-5)

Guidance literature:

With sodium acetate; acetic acid; at 70 ℃; for 27h; pH=3.8;

DOI:10.1021/jf0340815

Downstream raw materials:

2-(3,3,3-Trifluoropropyl)benzenesulfonamide

Refernces

• 1、 -. "N-phenylsulfonyl-N'-triazinylureas". . . Retrieved 2008/06/13.