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CAS No.: | 101200-48-0 |
---|---|
Name: | Tribenuron methyl |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C15H17N5O6S |
Molecular Weight: | 395.396 |
Synonyms: | Tribenuron methyl ester;DPX-L 5300;HCHA 92HE;Camer (pesticide);Benzoic acid,2-[[[[(4-methoxy-6-methyl-1,3,5- triazin-2-yl)methylamino]carbonyl]amino]- sulfonyl]-,methyl ester;Methyl 2-((((N-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)methylamino)carbonyl)amino)sulfonyl)benzoate;Cameo (pesticide);HCHA 92 HE;Express (pesticide);Sulfmethmeton-methyl;L 5300;Cameo;EPA Pesticide Chemical Code 128887;Express 75 DF;Pointer;Express;methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methyl-carbamoyl]sulfamoyl]benzoate;Tribenuron methyl 98%TC;Tribenuron methyl ester 95%TC;Tribenuron-methyl 97%TC,75%WDG;sell Tribenuron-methyl;Benzoic acid, 2-(((((4-methoxy-6-methyl-1,3,5-triazin-2-yl)methylamino)carbonyl)amino)sulfonyl)-, methyl ester; |
EINECS: | 401-190-1 |
Density: | 1.425 g/cm3 |
Melting Point: | 141 ºC |
Boiling Point: | 376.6oC |
Flash Point: | 181.6oC |
Solubility: | 28mg/L(pH=4)、50mg/L(pH=5)、280mg/L(pH=6) in water |
Appearance: | Colorless crystals |
Hazard Symbols: | Xi |
Risk Codes: | 43 |
Safety: | 22-24-37 |
PSA: | 149.06000 |
LogP: | 1.98160 |
tribenuron methyl
2-[4-methoxy-6-methyl-1,3,5-triazin-2-yl(methyl)carbamoylsulfamoyl]benzoic acid
Conditions | Yield |
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With sodium hydroxide In water at 20℃; for 1h; Hydrolysis; |
The IUPAC name of Tribenuron methyl is methyl 2-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-methylcarbamoyl]sulfamoyl]benzoate. With the CAS registry number 101200-48-0, it is also named as Sulfmethmeton-methyl. The product's categories are Herbicide; Alpha Sort; Herbicides; Pesticides & Metabolites; Q-ZAlphabetic; TP - TZPesticides & Metabolites; Urea Structure. It is colorless crystals which the solubility is as follows: acetone 43.8mg / L, acetonitrile 54.2mg / L, carbon tetrachloride 3.12mg / L, ethyl acetate 17.5mg / L, hexane 0.028mg / L, water 28mg/L(pH=4)、50mg/L(pH=5)、280mg/L(pH=6). What's more, this chemical is a sulfonylurea derivative. Hydrolysis occurs rapidly at pH <7 or >12. Additionally, it should be sealed in the container and stored in the cool and dry place.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.07; (4)ACD/LogD (pH 7.4):; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.95; (8)ACD/KOC (pH 7.4): 1.57; (9)#H bond acceptors: 11; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Index of Refraction: 1.582; (13)Molar Refractivity: 92.68 cm3; (14)Molar Volume: 277.3 cm3; (15)Polarizability: 36.74×10-24 cm3; (16)Surface Tension: 63.9 dyne/cm; (17)Rotatable Bond Count: 6; (18)Tautomer Count: 2; (19)Exact Mass: 395.089954; (20)MonoIsotopic Mass: 395.089954; (21)Topological Polar Surface Area: 149; (22)Heavy Atom Count: 27; (23)Complexity: 639.
Preparation of Tribenuron methyl: It can be obtained by the reaction of o-methyl formate phenylsulfonyl isocyanate and 2-methylamino-4-tetramethoxy-6-methyl triazine.
Uses of Tribenuron methyl: It is sulfonylurea herbicide which is used to control chickweed, shepherd's purse, silene conoidea, cleavers, cardamine, quinoa, amaranth and other annual broadleaf weeds in wheat field.
When you are using this chemical, please be cautious about it as the following:
It may cause sensitization by skin contact, so people should not breathe dust and avoid contact with skin. If you want to contact this product, you must wear suitable gloves.
People can use the following data to convert to the molecule structure.
1. SMILES:O=C(OC)c1ccccc1S(=O)(=O)NC(=O)N(c2nc(nc(OC)n2)C)C
2. InChI:InChI=1/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)
The following are the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
quail | LD50 | oral | > 2250mg/kg (2250mg/kg) | Pesticide Manual. Vol. 9, Pg. 840, 1991. | |
rabbit | LD50 | skin | > 2gm/kg (2000mg/kg) | Farm Chemicals Handbook. Vol. -, Pg. C132, 1991. | |
rat | LD50 | oral | > 5gm/kg (5000mg/kg) | Farm Chemicals Handbook. Vol. -, Pg. C132, 1991. |