Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate

C15H17N5O6S

methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate

CAS101200-48-0
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Warning

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Identification

CAS Number
101200-48-0
EC Number
401-190-1
UN Number
3077
Index Number
607-177-00-9
PubChem CID
153909

Physical-chemical properties

Molecular Formula
C15H17N5O6S
Molar Mass
395.40 g/mol
IUPAC Name
methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate

Chemical Identifiers

InChI
InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)
InChI Key
VLCQZHSMCYCDJL-UHFFFAOYSA-N

Overview

Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate (CAS 101200-48-0) is a triazine-derived sulfonylurea compound with herbicidal and plant growth regulation properties. This specialized chemical compound, with the molecular formula C15H17N5O6S and molecular weight of 395.4 g/mol, belongs to the sulfonylurea herbicide family characterized by its triazine ring system. The substance demonstrates selective herbicidal activity through inhibition of acetolactate synthase, an enzyme crucial for branched-chain amino acid biosynthesis in plants. Its structural complexity, featuring both sulfonamide and carbamate functionalities, provides specific binding affinity to target enzymes while maintaining selectivity between crop and weed species. The compound presents moderate safety concerns, classified under GHS pictograms GHS07, GHS08, and GHS09, indicating potential health and environmental hazards. It requires careful handling due to its classification as STOT RE 2 (specific target organ toxicity, repeated exposure), Skin Sens. 1 (skin sensitization), and aquatic toxicity categories Aquatic Acute 1 and Aquatic Chronic 1. The warning signal word and ADR Class 9 designation emphasize the need for proper storage and transportation protocols. Industrial applications primarily focus on agricultural formulations where precise herbicidal control is required, particularly in cereal crop protection systems. The compound also finds use in specialty agricultural research applications and as an intermediate in developing related herbicidal products. Unlike structurally different compounds such as 6-methyl-N-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide, this triazine derivative offers specific selectivity profiles valuable in targeted weed management programs. OYSI provides reliable access to this technical-grade compound for qualified industrial customers requiring consistent quality standards for their specialized applications.

Safety & Classification

Warning
Classification:

STOT RE 2; Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H373

May cause damage to organs through prolonged or repeated exposure.

H317

May cause an allergic skin reaction.

H400

Very toxic to aquatic life.

H410

Very toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Skin Contact

Irritant

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3077
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameTribenuron-methyl (ISO)
Marine PollutantNo

Frequently Asked Questions

What is methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate?

Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate is an organic chemical compound with CAS number 101200-48-0 and molecular formula C15H17N5O6S. This substance belongs to the triazine derivative family and has a molecular weight of 395.4 g/mol. It is classified as a hazardous substance with specific target organ toxicity, skin sensitization potential, and environmental toxicity properties.

What are the physicochemical properties of methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate?

Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate is a complex organic molecule with molecular formula C15H17N5O6S and molecular weight 395.4 g/mol. The compound contains triazine, sulfonamide, and benzoate functional groups, which influence its chemical behavior and solubility characteristics. Specific physical properties such as melting point, boiling point, and solubility data should be obtained from the manufacturer's technical data sheet.

What is methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate used for?

Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate is primarily used as an intermediate in chemical synthesis and pharmaceutical applications. Its triazine structure suggests potential use in agrochemical formulations or as a building block for more complex molecules. The compound may also serve specialized applications in research and development within the chemical industry, particularly in processes requiring specific reactivity patterns.

How to handle methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate safely?

Safe handling requires appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing due to its skin sensitization properties (Skin Sens. 1). Work in well-ventilated areas or use local exhaust ventilation to minimize inhalation exposure, considering its STOT RE 2 classification. Avoid direct skin contact and ensure proper hygiene measures. Emergency eyewash and shower facilities should be readily accessible during handling operations.

How to store methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate correctly?

Proper storage requires keeping the substance in a cool, dry, well-ventilated area away from incompatible materials. Store in original, tightly sealed containers to prevent contamination and moisture absorption. Due to its environmental hazard classification (Aquatic Acute 1; Aquatic Chronic 1), ensure secondary containment to prevent environmental release. Keep away from heat sources, direct sunlight, and maintain storage temperature as specified by the manufacturer.

What to do in case of contact with methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate?

Immediate skin contact requires thorough washing with soap and water for at least 15 minutes, removing contaminated clothing. For eye contact, flush immediately with clean water for 15-20 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Due to the skin sensitization potential, monitor for allergic reactions. Seek immediate medical attention if symptoms develop or persist, bringing the safety data sheet for medical reference.

How to dispose of methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate properly?

Disposal must comply with local, national, and international hazardous waste regulations due to its environmental hazard classification. Contact licensed hazardous waste disposal companies for proper treatment and disposal. Do not discharge to drains, soil, or water bodies given its aquatic toxicity (Aquatic Acute 1; Aquatic Chronic 1). Empty containers should be triple-rinsed and disposed of according to local regulations, maintaining proper waste documentation.

How to transport methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate?

Transportation follows ADR Class 9 (Miscellaneous dangerous substances), Packing Group III requirements. Use UN-approved packaging suitable for Class 9 materials and ensure proper dangerous goods documentation accompanies shipments. Vehicles must carry appropriate emergency equipment and drivers require dangerous goods training certification. Packages must display correct hazard labels (GHS07, GHS08, GHS09) and proper shipping names as per ADR regulations.

Is methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate subject to specific regulations?

Yes, this substance is subject to REACH regulation requiring registration for manufacture or import above one tonne annually in the EU. CLP regulation mandates classification as STOT RE 2, Skin Sens. 1, Aquatic Acute 1, and Aquatic Chronic 1 with Warning signal word. It is not currently identified as a Substance of Very High Concern (SVHC). Companies must comply with safety data sheet requirements and proper labeling obligations.

Where to buy methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate in Europe?

OYSI serves as a reliable European distributor for methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate, providing comprehensive supply chain solutions across European markets. As a specialized chemical distributor, OYSI ensures proper handling, storage, and documentation compliance for this regulated substance. Contact OYSI directly for availability, technical specifications, and regulatory documentation to support your specific application requirements.

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Methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate is a dangerous good. We support you with labeling, packaging, and transport documentation.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.