- 58909-56-15-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-amino-8-oxo-3-[[(1,2,5,6-tetrahydro-2-methyl-5,6-dioxo-1,2,4-triazin-3-yl)thio]methyl]-,(6R,7R)-
- 589-10-6Benzene,(2-bromoethoxy)-
- 5891-21-45-Chloro-2-pentanone
- 5891-41-8L-Alanine,N-[(phenylmethoxy)carbonyl]glycyl-L-prolyl- (9CI)
- 5891-45-2L-Glutamic acid,N-[(phenylmethoxy)carbonyl]-, 1-(1,1-dimethylethyl) ester
- 589-15-1Benzene,1-bromo-4-(bromomethyl)-
- 589-16-2Benzenamine, 4-ethyl-
- 58917-25-22(3H)-Furanone,dihydro-5-methyl-, (5R)-
- 58917-26-35-Hepten-2-ol,6-methyl-,(2S)-
- 58917-27-45-Hepten-2-ol,6-methyl-,(2R)-
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione |
EINECS | 261-490-1 |
| CAS No. | 58909-39-0 | Density | 1.62 g/cm3 |
| PSA | 102.74000 | LogP | -0.86880 |
| Solubility | N/A | Melting Point |
168-171 °C(lit.) |
| Formula | C4H5N3O2S | Boiling Point | 272.3 °C at 760 mmHg |
| Molecular Weight | 159.169 | Flash Point | 118.5 °C |
| Transport Information | N/A | Appearance | white powder |
| Safety | 36 | Risk Codes | 20/21/22 |
| Molecular Structure |
|
Hazard Symbols | Xi |
| Synonyms |
2,5-Dihydro-6-Hydroxy-3-Mercapto-2-Methyl-5-oxo-1,2,4-Triazine ( TTZ , Thiotriazinone );2-Methyl-5,6-dioxo-1,2,5,6-tetrahydro-1,2,4-triazine-3-thiol; |
Article Data | 7 |
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione Synthetic route
- 6938-68-7
2-methyl-thiosemicarbazide
- 95-92-1
oxalic acid diethyl ester
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
| Conditions | Yield |
|---|---|
| With dmap; N,N,N,N,-tetramethylethylenediamine; sodium methylate In methanol; ethanol at 15 - 55℃; for 4h; Temperature; Solvent; Reagent/catalyst; | 92.7% |
| With sodium methylate In methanol; dimethyl sulfoxide at 0 - 45℃; Solvent; | 91.6% |
- 553-90-2
Dimethyl oxalate
- 60-34-4
methylhydrazine
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
| Conditions | Yield |
|---|---|
| Stage #1: ammonium thiocyanate; methylhydrazine In water at 95 - 100℃; Stage #2: Dimethyl oxalate With sodium methylate In methanol at 65 - 75℃; for 6h; Temperature; | 75% |
A
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
C
- 153470-19-0
C14H13N5O6S2(2-)
| Conditions | Yield |
|---|---|
| With Carbonate buffer at 37℃; Rate constant; H/D-isotopic effect were studied too; |
A
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
| Conditions | Yield |
|---|---|
| With Carbonate buffer at 37℃; Rate constant; H/D-isotopic effect were studied too; |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 94088-75-2
2-(2-amino-1,3-thiazol-4-yl)-1-(1,3-benzothiazol-2-ylsulfanyl)-2-(methoxyimino)ethan-1-one
- 957-68-6
7-Aminocephalosporanic acid
| Conditions | Yield |
|---|---|
| Stage #1: 2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine; 7-Aminocephalosporanic acid With carbonic acid dimethyl ester at 35℃; for 1h; Stage #2: 2-(2-amino-1,3-thiazol-4-yl)-1-(1,3-benzothiazol-2-ylsulfanyl)-2-(methoxyimino)ethan-1-one for 0.166667h; Stage #3: With triethylamine at 10℃; for 4h; Concentration; Temperature; | 99.5% |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 957-68-6
7-Aminocephalosporanic acid
- 58909-56-1
7-aminoceftrizine
| Conditions | Yield |
|---|---|
| With boron trifluoride dimethyl carbonate complex; methanesulfonic acid at 10 - 12℃; for 0.383333h; Reagent/catalyst; | 95.1% |
| With boron trifluoride dimethyl carbonate complex; edetate disodium at 30℃; for 0.833333h; Time; | 90% |
| With boron trifluoride In acetonitrile at 10 - 30℃; for 0.5h; | 85.71% |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 957-68-6
7-Aminocephalosporanic acid
- 58909-56-1
7-amino-3-[(2,5-dihydro-6-hydroxy-2-methyl-5-oxo-1,2,4-triazine-3-mercapto)methyl]-3 cephalosporin-4-carboxylic acid
| Conditions | Yield |
|---|---|
| With aluminum (III) chloride; boron trifluoride; carbonic acid dimethyl ester at 5 - 30℃; for 1h; | 92% |
| With aluminum (III) chloride; boron trifluoride; carbonic acid dimethyl ester at 5 - 30℃; for 1h; Reagent/catalyst; | 90% |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 143731-84-4
7α-methoxy-8-oxo-2-(pyrrolidinocarbonyl)-3-(chloromethyl)-5-thia-1-azabicyclo<4.2.0>oct-2-ene 5,5-dioxide
- 119742-06-2
L-659,286
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In water; acetone for 16h; Ambient temperature; | 85% |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 7585-39-9
fipronilβ-cyclodextrin
| Conditions | Yield |
|---|---|
| In water at 30℃; for 24.5h; | 83% |
- 58909-39-0
2-methyl-3-mercapto-5-oxo-6-hydroxy-2,5-dihydro-1,2,4-triazine
- 95672-05-2
1,1-dimethylethyl 3-(chloromethyl)-7α-methoxy-8-oxo-5-thia-1-azabicyclo<4.2.0>oct-2-ene-2-carboxylate 5,5-dioxide
- 116536-09-5
1,1-dimethylethyl 7α-methoxy-3-{[(1,2,5,6-tetrahydro-5,6-dioxo-2-methyl-as-triazin-3-yl)thio]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In water; acetone | 80% |
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione Chemical Properties
The Molecular Structure of Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione (CAS NO.58909-39-0):
Empirical Formula: C4H5N3O2S
Molecular Weight: 159.1664
IUPAC: 2-methyl-3-sulfanylidene-1,2,4-triazinane-5,6-dione
Product Categories: Building Blocks;Heterocyclic Building Blocks;Triazines
Nominal Mass: 159 Da
Average Mass: 159.1664 Da
Monoisotopic Mass: 159.010246 Da
Index of Refraction: 1.678
Molar Refractivity: 37.04 cm3
Molar Volume: 98.1 cm3
Surface Tension: 87.6 dyne/cm
Density: 1.62 g/cm3
Flash Point: 118.5 °C
Enthalpy of Vaporization: 59.28 kJ/mol
Boiling Point: 272.3 °C at 760 mmHg
Vapour Pressure: 0.000795 mmHg at 25°C
InChI
InChI=1/C4H5N3O2S/c1-7-4(10)5-2(8)3(9)6-7/h1H3,(H,6,9)(H,5,8,10)
Smiles
[nH]1c(n(C)[nH]c(c1=O)=O)=S
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione Uses
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione (CAS NO.58909-39-0) can be used as intermediates of ceftriaxone, ceftriaxone sodium, etc. drugs.
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione Safety Profile
Risk Statements: 20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed
Safety Statements: 36
S36:Wear suitable protective clothing
WGK Germany: 3
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione Specification
Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione (CAS NO.58909-39-0) is also called as EINECS 261-490-1 .
What can I do for you?
Get Best Price
