1125828-30-9

Basic information

• Product Name: 1-(4-Chloro-2-(3-Methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone
• Synonyms: 1-(4-Chloro-2-(3-Methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone;1-(4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethan-1-one;EOS-61312;Ethanone, 1-[4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl]-2,2,2-trifluoro-;1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethanone
• CAS NO: 1125828-30-9
• Molecular Formula: C₁₂H₈ClF₃N₂O
• Molecular Weight: 288.6529296
• Mol File: 1125828-30-9.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 365.4±42.0 °C(Predicted)
• Appearance: /
• Density: 1.41±0.1 g/cm3(Predicted)
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: -0.26±0.12(Predicted)
• CAS DataBase Reference: 1-(4-Chloro-2-(3-Methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(4-Chloro-2-(3-Methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone(1125828-30-9)
• EPA Substance Registry System: 1-(4-Chloro-2-(3-Methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone(1125828-30-9)

Safety Data

• Hazardous Substances Data: 1125828-30-9(Hazardous Substances Data)

Upstream product

• 1453-58-3 3-Methylpyrazole 
• 383-63-1 ethyl trifluoroacetate, 
• 1996-29-8 1-bromo-4-chloro-2-fluorobenzene 
• 1125828-26-3 1-(2-bromo-5-chlorophenyl)-3-methyl-1H-pyrazole 
• 1125828-28-5 1-(2-bromo-5-chlorophenyl)-5-methyl-1H-pyrazole 

Downstream Products

• 1033805-26-3 (R)-1-(4-chloro-2-(3-methyl-1H-pyrazole-1-yl)phenyl)-2,2,2-trifluoroethane-1-ol 

Relevant articles and documents

Discovery of spirocyclic proline tryptophan hydroxylase-1 inhibitors

The central role of the biogenic monoamine serotonin (5-hydroxytryptamine, 5-HT) as a neurotransmitter with important cognitive and behavioral functions is well known. However, 5-HT produced in the brain only accounts for approximately 5% of the total amount of 5-HT generated in the body. At the onset of our work, it appeared that substituted phenylalanine derivatives or related aryl amino acids were required to produce potent inhibitors of TPH1, as significant losses of inhibitory activity were noted in the absence of this structural element. We disclose herein the discovery of a new class of TPH1 inhibitors that significantly lower peripherally 5-HT.

METHODS OF PREPARING 4-PHENYL-6-(2,2,2-TRIFLUORO-1-PHENYLETHOXY)PYRIMIDINE-BASED COMPOUNDS

Methods useful for preparing compounds of formula I: and salts thereof are disclosed. Also disclosed are intermediates useful in the preparation of such compounds.