Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate
- Product Name
- Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate
- CAS No.
- 3641-14-3
- Chemical Name
- Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate
- Synonyms
- Asciminib Impurity 21;5-AMINO-1H-1 2 4-TRIAZOLE-3-CARBOXYLIC;3-Amino-5-(methoxycarbonyl)-1,2,4-triazole;Methyl 5-aMino-1,2,4-triazole-3-carboxylate;Methyl 3-aMino-1,2,4-triazole-5-carboxylate;ethyl 5-aMino-1H-1,2,4-triazole-3-carboxylate;Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate;Methyl 5-aMino-2H-1,2,4-triazole-3-carboxylate;methyl 3-azanyl-1H-1,2,4-triazole-5-carboxylate;2,4-triazole-3-carboxylicacid,5-amino-1h-methylester
- CBNumber
- CB4498603
- Molecular Formula
- C4H6N4O2
- Formula Weight
- 142.12
- MOL File
- 3641-14-3.mol
Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate Property
- Melting point:
- 218-222 °C (lit.)
- Boiling point:
- 379.0±25.0 °C(Predicted)
- Density
- 1.505±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 8.92±0.40(Predicted)
- form
- Crystalline Powder
- color
- White
- InChI
- InChI=1S/C4H6N4O2/c1-10-3(9)2-6-4(5)8-7-2/h1H3,(H3,5,6,7,8)
- InChIKey
- MGRNUMFYRVKLEO-UHFFFAOYSA-N
- SMILES
- N1C(N)=NC(C(OC)=O)=N1
- CAS DataBase Reference
- 3641-14-3(CAS DataBase Reference)
N-Bromosuccinimide Price
- Product number
- 573787
- Product name
- 5-Amino-1H-[1,2,4]-triazole-3-carboxylic acid methyl ester
- Purity
- 96%
- Packaging
- 1g
- Price
- $47.18
- Updated
- 2025/07/31
- Product number
- M328680
- Product name
- Methyl5-amino-1h-1,2,4-triazole-3-carboxylate
- Packaging
- 500mg
- Price
- $65
- Updated
- 2021/12/16
- Product number
- 455626
- Product name
- Methyl 5-amino-1h-1,2,4-triazole-3-carboxylate
- Packaging
- 100mg
- Price
- $305
- Updated
- 2021/12/16
- Product number
- M328680
- Product name
- Methyl5-amino-1h-1,2,4-triazole-3-carboxylate
- Packaging
- 100mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- 073914
- Product name
- Methyl 5-amino-4H-[1,2,4]triazole-3-carboxylate
- Purity
- 95+%
- Packaging
- 1g
- Price
- $278
- Updated
- 2021/12/16
Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate Chemical Properties,Usage,Production
Synthesis
67-56-1
3641-13-2
3641-14-3
To a solution of 5-amino-1H-1,2,4-triazole-3-carboxylic acid (3.9 g, 30.45 mmol) in methanol (100 mL) was slowly added thionyl chloride (SOCl2, 12 g, 100.84 mmol). The reaction mixture was stirred at 70 °C for 48 hours. Upon completion of the reaction, the mixture was concentrated under reduced pressure to remove the solvent. The residue was dissolved in water (100 mL) and the pH was adjusted with saturated sodium bicarbonate (NaHCO3) solution to 8. Subsequently, the aqueous phase was extracted with dichloromethane (3 x 50 mL). The organic layers were combined, dried with anhydrous magnesium sulfate, filtered and concentrated under reduced pressure to afford methyl 5-amino-1H-1,2,4-triazole-3-carboxylate as a white solid (800 mg, 65% yield). The product was confirmed by LC/MS (ES, m/z): [M + H]+ 143.0. 1H NMR (300 MHz, DMSO-d6): δ 3.85 (s, 3H).
References
[1] Chemical and Pharmaceutical Bulletin, 2004, vol. 52, # 2, p. 192 - 198
[2] Russian Journal of Applied Chemistry, 2006, vol. 79, # 5, p. 783 - 786
[3] Patent: WO2014/66743, 2014, A1. Location in patent: Paragraph 0146
Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate Preparation Products And Raw materials
Raw materials
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View Lastest Price from Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate manufacturers
- Product
- Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate 3641-14-3
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 20t
- Release date
- 2024-07-15
- Product
- Methyl 5-amino-1H-1,2,4-triazole-3-carboxylate 3641-14-3
- Price
- US $15.00-10.00/KG
- Min. Order
- 1KG
- Purity
- 99%+ HPLC
- Supply Ability
- Monthly supply of 1 ton
- Release date
- 2021-07-11