| Identification | Back Directory | [Name]
3-METHYL-1-[2-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOL-5-AMINE | [CAS]
380238-10-8 | [Synonyms]
AKOS BBS-00006677 5-Methyl-2-[2-(trifluoromethyl)phenyl]pyrazol-3-amine 3-METHYL-1-[2-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOL-5-AMINE 5-METHYL-2-(2-TRIFLUOROMETHYL-PHENYL)-2H-PYRAZOL-3-YLAMINE 1H-Pyrazol-5-amine, 3-methyl-1-[2-(trifluoromethyl)phenyl]- 5-Amino-3-methyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrazole, 2-(5-Amino-3-methyl-1H-pyrazol-1-yl)benzotrifluoride | [EINECS(EC#)]
200-258-5 | [Molecular Formula]
C11H10F3N3 | [MDL Number]
MFCD02715834 | [MOL File]
380238-10-8.mol | [Molecular Weight]
241.21 |
| Chemical Properties | Back Directory | [Boiling point ]
342.7±42.0 °C(Predicted) | [density ]
1.35±0.1 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Inert atmosphere,Room temperature | [form ]
powder | [pka]
3.37±0.10(Predicted) | [color ]
Off-white |
| Hazard Information | Back Directory | [Synthesis]
GENERAL METHOD: 3-Aminobut-2-enenenitrile (10 mmol) was added to a suspension of (2-(trifluoromethyl)phenyl)hydrazine (10 mmol) in 12 M HCl-H2O (12 mL, 1:3 v/v). The reaction mixture was heated to reflux for 12 h, subsequently cooled to room temperature and neutralized with 2.5 M NaOH solution. The reaction mixture was extracted with dichloromethane (3 x 30 mL). The organic phases were combined, washed with saturated saline (20 mL), dried over anhydrous sodium sulfate and concentrated under reduced pressure. The residue was ground with hexane to give a solid product, which was separated by filtration. If necessary, the product was purified by column chromatography. | [References]
[1] Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 11, p. 3429 - 3445 [2] Patent: WO2010/20363, 2010, A1. Location in patent: Page/Page column 136-137 [3] Journal of Combinatorial Chemistry, 2010, vol. 12, # 4, p. 510 - 517 |
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