52888-80-9

Basic information

• Product Name: PROSULFOCARB
• Synonyms: PROSULFOCARB;S-BENZYL DIPROPYLTHIOCARBAMATE;BOXER;DEFI;arkade;benzyldipropylthiolcarbamate;boxer(iciagrochemicals);dipropyl-carbamothioicacis-(phenylmethyl)ester
• CAS NO: 52888-80-9
• Molecular Formula: C₁₄H₂₁NOS
• Molecular Weight: 251.39
• EINECS: 401-730-6
• Mol File: 52888-80-9.mol
• Article Data: 8

Chemical Properties

• Melting Point: 25°C
• Boiling Point: 352.6°Cat760mmHg
• Flash Point: 100 °C
• Appearance: /
• Density: 1.0696 (rough estimate)
• Vapor Pressure: 3.79E-05mmHg at 25°C
• Refractive Index: 1.7500 (estimate)
• PKA: -1.22±0.70(Predicted)
• Water Solubility: 13 mg l-1
• BRN: 4804364
• CAS DataBase Reference: PROSULFOCARB(CAS DataBase Reference)
• NIST Chemistry Reference: PROSULFOCARB(52888-80-9)
• EPA Substance Registry System: PROSULFOCARB(52888-80-9)

Safety Data

• Hazard Codes: Xn,N
• Statements: 22-43-51/53
• Safety Statements: 24-37-61
• RIDADR: UN 3082 9/PG 3
• WGK Germany: 2
• RTECS: FD3835000
• Hazardous Substances Data: 52888-80-9(Hazardous Substances Data)

Usage

Uses

Prosulfocarb is a pesticide used in the protection of crops such as barley for its herbicidal activity.

Definition

ChEBI: A monothiocarbamic ester that is carbamothioic S-acid substituted by two propyl groups at the nitrogen atom and a benzyl group at the the sulfur atom.

Synthesis Reference(s)

Tetrahedron, 49, p. 2403, 1993 DOI: 10.1016/S0040-4020(01)86319-5

Reactivity Profile

PROSULFOCARB is a thiocarbamate. Flammable gases are generated by the combination of thiocarbamates and dithiocarbamates with aldehydes, nitrides, and hydrides. Thiocarbamates and dithiocarbamates are incompatible with acids, peroxides, and acid halides.

InChI:InChI=1/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3

Upstream product

• 100-44-7 benzyl chloride 
• 71280-90-5 Dipropyl-thiocarbamic acid; compound with dipropyl-amine 
• 124-38-9 carbon dioxide 
• 142-84-7 di-n-propylamine 
• 100-53-8 phenylmethanethiol 
• 106-94-5 propyl bromide 
• 39077-95-7 S-benzyl N-propylthiocarbamate 
• 37734-45-5 benzyl chlorothioformate 
• 201230-82-2 carbon monoxide 
• 100-39-0 benzyl bromide 

Relevant articles and documents

HERBICIDAL COMPOSITIONS

The present invention provides compositions comprising herbicidally active compounds (A) and (B), where (A) represents one or more compounds of the general formula (I) or agrochemically compatible salts thereof [component (A)], and (B) represents one or more herbicides [component (B)]. The application further relates to a method and to the use of the herbicidal composition according to the invention for controlling harmful plants or for regulating growth.

An efficient, one-pot synthesis of S-alkyl thiocarbamates from the corresponding thiols using the Mitsunobu reagent

A novel Mitsunobu-based protocol has been developed for the synthesis of variety of S-alkyl thiocarbamates from the corresponding thiols and amines using gaseous carbon dioxide, in good to excellent yields. This protocol is mild and efficient compared to other reported methods. Georg Thieme Verlag Stuttgart.

Practical synthesis of S-alkyl thiocarbamate herbicides by carbonylation of amines with carbon monoxide and sulfur

An industrial and economic carbonylation of amines with carbon monoxide and sulfur has been developed for the synthesis of S-alkyl thiocarbamate herbicides. In the presence of potassium carbonate and solvent DMSO, S-alkyl thiocarbamates, such as thiobencarb and orbencarb (herbicides) are synthesized in excellent yields from amines, carbon monoxide, sulfur, and alkyl halides under mild conditions (1atm, 20°C).