| Identification | More | [Name]
2,4-Bis(ethylamino)-6-(methylthio)-1,3,5-triazine | [CAS]
1014-70-6 | [Synonyms]
2,4-BIS(ETHYLAMINO)-6-METHYLTHIO-1,3,5-TRIAZINE
AURORA KA-3877
G32911
GY-BON
GYBON(R)
N,N'-DIETHYL-6-(METHYLTHIO)-1,3,5-TRIAZINE-2,4-DIAMINE
SIMETRYN
SIMETRYNE
1,3,5-Triazine-2,4-diamine, N,N'-diethyl-6-(methylthio)-
1,3,5-Triazine-2,4-diamine,N,N’-diet
2-(Methylmercapto)-4,6-bis(ethylamino)-s-triazine
2-(Methylthio)-4,6-bis(ethylamino)-s-triazine
2,4-Bis(ethylamino)-6-(methylmercapto)-s-triazine
2,4-bis(ethylamino)-6-(methylthio)-s-triazin
2,4-Bis(ethylamino)-6-(methylthio)-s-triazine
2,4-bis(Ethylamino)-6-methylmercapto-S-triazine
2-methylmercapto-4,6-bis(ethylamino)-s-triazine
2-methylthio-4,6-bis(ethylamino)-1,3,5-triazine
2-methylthio-4,6-bis(ethylamino)-s-triazine
2-Methylthio-4,6-bis(monoethylamino)-2-triazine | [EINECS(EC#)]
213-801-7 | [Molecular Formula]
C8H15N5S | [MDL Number]
MFCD00078720 | [Molecular Weight]
213.3 | [MOL File]
1014-70-6.mol |
| Chemical Properties | Back Directory | [Melting point ]
82-83°C | [Boiling point ]
312.8°C (rough estimate) | [density ]
1.1553 (rough estimate) | [refractive index ]
1.5500 (estimate) | [storage temp. ]
0-6°C | [solubility ]
DMF: 30 mg/mL; DMSO: 30 mg/mL; Ethanol: 30 mg/mL; Ethanol:PBS (pH 7.2) (1:4): 0.2 mg/mL | [form ]
neat | [pka]
4.05±0.10(Predicted) | [color ]
White to off-white | [Water Solubility ]
0.45g/L(room temperature) | [Merck ]
13,8610 | [BRN ]
11728 | [Henry's Law Constant]
2.2×104 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) | [Major Application]
agriculture
environmental | [InChI]
1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13) | [InChIKey]
MGLWZSOBALDPEK-UHFFFAOYSA-N | [SMILES]
CCNc1nc(NCC)nc(SC)n1 | [CAS DataBase Reference]
1014-70-6(CAS DataBase Reference) | [NIST Chemistry Reference]
2-Methylthio-4,6-bis(ethylamino)-1,3,5-triazine(1014-70-6) | [EPA Substance Registry System]
1014-70-6(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn;N,N,Xn | [Risk Statements ]
R22:Harmful if swallowed.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment . | [Safety Statements ]
S2:Keep out of the reach of children .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet . | [RIDADR ]
UN 3077 9/PG 3 | [WGK Germany ]
3 | [RTECS ]
XY4025000 | [HS Code ]
29336990 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1 | [Toxicity]
LD50 orally in rats: 1830 mg/kg (Edson) |
| Hazard Information | Back Directory | [Description]
Simetryne is a white crystal, easily soluble in methanol, ethanol, chloroform and other organic solvents; its solubility in water is 450mg/L at 22°C. It is easily decomposed in case of acid, alkali or high temperature. It is a selective, systemic and transmissible triazepine herbicide, which can be absorbed through the roots and leaves of weeds, and transmitted to the whole body of the plant, inhibiting the photosynthesis of weeds, and causing the leaves to die due to lack of greenness and yellowing. | [Uses]
Herbicide. | [Uses]
Simetryne is mainly used in paddy field to prevent barnyardgrass, ox hair grass, sagebrush, Alisma, wild cigu, mother grass, Xiaoci grass, etc. It can be used in combination with salamander and butachlor to expand the herbicide spectrum and can also be used for corn. , soybean, wheat, peanut, cotton and other weeding. | [Uses]
Simetyrn is an methylthiotriazine based herbicide used in rice paddy.
| [Definition]
ChEBI: A diamino-1,3,5-triazine that is N,N'-diethyl-1,3,5-triazine-2,4-diamine substituted by a methylthio group at position 6. | [Mechanism of action]
Selective systemic, absorbed through roots and foliage, inhibits photosynthesis (photosystem II). | [Synthesis]
In the presence of sodium hydroxide, cyanuric chloride reacts with monoethylamine and sodium methyl mercaptan to give Simetryne. | [storage]
Store at -20°C | [Pesticide Type]
Herbicide |
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