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4-Amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5(4H)-one

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Identification
Molecular formula
C8H14N4OS
CAS number
22198-72-3
IUPAC name
4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one
State
State

At room temperature, this compound is typically in a solid state.

Melting point (Celsius)
155.00
Melting point (Kelvin)
428.15
Boiling point (Celsius)
196.50
Boiling point (Kelvin)
469.65
General information
Molecular weight
198.29g/mol
Molar mass
198.2700g/mol
Density
1.2000g/cm3
Appearence

This compound generally appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one

The solubility of 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one can be influenced by various factors, as is common with many chemical compounds. Understanding its solubility is essential for practical applications in fields such as pharmaceuticals and agrochemicals. Here are some key points regarding its solubility:

  • Polarity: The presence of amino and sulfanyl groups suggests potential solubility in polar solvents like water.
  • Hydrophobic Characteristics: The tert-butyl group may introduce hydrophobic characteristics, potentially decreasing solubility in water.
  • Solvent Interactions: Solubility may vary significantly depending on the interacting solvents, including organic solvents like ethanol or acetone.
  • Temperature Dependency: The solubility behavior may change with temperature, generally increasing at elevated temperatures.

In conclusion, predicting solubility requires considering the balance between hydrophilic and hydrophobic factors. As a rule of thumb, "like dissolves like," meaning that polar compounds tend to dissolve well in polar solvents, while non-polar compounds prefer non-polar solvents. Therefore, experimental determination is often necessary for accurate solubility data on 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one.

Interesting facts

Interesting Facts About 4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one

4-Amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one is a fascinating compound that belongs to the class of triazines, which have attracted considerable interest in various fields of research. Here are some intriguing aspects of this compound:

  • Biological Significance: This compound exhibits potential biological activity, making it a subject of study in medicinal chemistry. Its structural characteristics suggest possible applications in antibiotic and antiviral development.
  • Agricultural Applications: Due to its ability to inhibit certain biochemical pathways in plants, compounds similar to this one are often explored for use as herbicides, providing a means of managing agricultural weeds effectively.
  • Synthetic Route: The synthesis of 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one may involve multi-step reactions, showcasing the creativity and complexity inherent in organic synthesis.
  • Structural Diversity: The presence of both amino and methylsulfanyl groups contributes to the compound's diverse chemical behavior, allowing for potential modifications that could yield new derivatives with enhanced properties.

As a result of its diverse properties and potential applications, 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one serves as a prime example of how structural modifications can lead to significant changes in activity and usability in both biological and ecological contexts.

In the words of a prominent chemist: "Exploring the uncharted territories of chemical compounds can often lead to revolutionary discoveries that might redefine the boundaries of science."

Synonyms
METRIBUZIN
21087-64-9
Lexone
Sencor
Metribuzine
Zenkor
Sencorex
Senkor
Lexone DF
Sencor DF
Lexone 4L
Sencor 4F
Sencoral
Bayer 6159H
Bayer 6443H
Bay 94337
Bayer 94337
Sencorex L.F.
BAY dic 1468
Sencorer
1,2,4-Triazin-5(4H)-one, 4-amino-6-(1,1-dimethylethyl)-3-(methylthio)-
DIC 1468
4-Amino-6-tert-butyl-4,5-dihydro-3-methylthio-1,2,4-triazin-5-one
BAY 61597
NTN 70
DTXSID6024204
CHEBI:34846
QO836138OV
4-Amino-6-(1,1-dimethylethyl)-3-(methylthio)-1,2,4-triazin-5(4H)-one
4-Amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5-one
3-Methylthio-4-amino-6-tert-butyl-1,2,4-triazin-5-one
DTXCID404204
4-Amino-6-tert-butyl-3-(methylthio)-as-triazin-5(4H)-one
1,2,4-Triazin-5-one, 4-amino-6-tert-butyl-3-(methylthio)-
4-amino-6-tert-butyl-3-(methylsulfanyl)-4,5-dihydro-1,2,4-triazin-5-one
4-Amino-6-tert-butyl-3-methylthio-as-triazin-5-one
4-Amino-6-tert-butyl-3-methylthio-1,2,4-triazin-5(4H)-one
4-Amino-6-tert-butyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Sengoral
Sencor 4
RefChem:818778
244-209-7
4-Amino-6-tert-butyl-3-methylsulfanyl-4H-[1,2,4]triazin-5-one
4-amino-6-(tert-butyl)-3-(methylthio)-1,2,4-triazin-5(4H)-one
C8H14N4OS
4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one
MFCD00055525
as-Triazin-5(4H)-one, 4-amino-6-tert-butyl-3-(methylthio)-
4-amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5(4H)-one
F0111-0053
CAS-21087-64-9
Caswell No. 033D
Metribuzin [BSI:ISO]
Metribuzine [ISO-French]
HSDB 6844
Sencor 4L
EINECS 244-209-7
Segal (Salt/Mix)
Canopy (Salt/Mix)
Lexone 75DF
Salute (Salt/Mix)
Sencor 75DF
EPA Pesticide Chemical Code 101101
BRN 0746650
METRIBUZIN [MI]
Bayer 6159
METRIBUZIN [ISO]
METRIBUZIN [HSDB]
SencorlPreview (Salt/Mix)
Cambridge id 5373044
Oprea1_252886
Oprea1_806124
SCHEMBL66824
BIDD:ER0414
UNII-QO836138OV
orb1696115
CHEMBL1902519
FOXFZRUHNHCZPX-UHFFFAOYSA-
BAY 6159 H
HMS1582I20
SMSSF-0061155
BAY 6159
Tox21_202006
Tox21_300731
BBL028065
STK830450
Metribuzin 500 microg/mL in Acetone
AKOS000116775
Metribuzin 200 microg/mL in Methanol
GS-3125
Metribuzin 10 microg/mL in Cyclohexane
Metribuzin 10 microg/mL in Acetonitrile
NCGC00163856-01
NCGC00163856-02
NCGC00163856-03
NCGC00163856-04
NCGC00254637-01
NCGC00259555-01
Metribuzin 100 microg/mL in Acetonitrile
DB-045478
HY-116954
CS-0066904
M3383
NS00001636
ST50309413
EN300-03840
Metribuzin, PESTANAL(R), analytical standard
H10483
087M649
5-26-06-00432 (Beilstein Handbook Reference)
A815132
Q421450
SR-01000393620
SR-01000393620-1
Z56755860
4-amino-6-t-butyl-3-methylthio-1,2,4-triazin-5-one
4-amino-6-(tert-butyl)-3-methylthio-1,2,4-triazin-5-one
4-amino-6-t-butyl-3-methylmercapto-1,2,4-triazin-5-one
4-amino-6-tert.-butyl-3-methylthio-1,2,4-triazin-5-one
Triazin-5(4H)-one, 4-amino-6-tert-butyl-3-(methylthio)-
3-methylthio-4-amino-6-tert.-butyl-1,2,4-triazin-5(4H)-one
4-amino-6-tert.-butyl-3-methylthio-1,2,4-triazin-5(4H)-one
4-azanyl-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one
6-tert.-butyl-3-methylthio-4-amino-1,2,4-triazin-5(4H)-one
4-amino-6-(t-butyl)-3-(methylthio)-1,2,4-triazine-5(4H)-one
4-amino-6-tert.-butyl-3-methylthio-1,2,4-triazin-5-(4H)-one
4-Amino-6-tert-butyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one #
InChI=1/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3