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2-HYDROXY-2-[4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE, also known as 4-(Trifluoromethyl)phenethyl alcohol, is a chemical compound with the molecular formula C10H12F3NO. It features a hydroxyl group and an amine group, and is used in the production of pharmaceuticals and agrochemicals. This colorless liquid with a strong odor is considered a hazardous chemical, with potential health effects such as skin and eye irritation, respiratory and gastrointestinal issues, and central nervous system depression. It is of interest in medicinal chemistry due to its potential pharmacological activities and is used as a building block in the synthesis of various biologically active compounds.

776-02-3

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776-02-3 Usage

Uses

Used in Pharmaceutical Industry:
2-HYDROXY-2-[4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE is used as an intermediate in the synthesis of pharmaceuticals for its potential pharmacological activities, contributing to the development of new drugs with therapeutic benefits.
Used in Agrochemical Industry:
2-HYDROXY-2-[4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE is used as a building block in the production of agrochemicals, playing a role in the creation of compounds that can enhance crop protection and yield.

Check Digit Verification of cas no

The CAS Registry Mumber 776-02-3 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 7,7 and 6 respectively; the second part has 2 digits, 0 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 776-02:
(5*7)+(4*7)+(3*6)+(2*0)+(1*2)=83
83 % 10 = 3
So 776-02-3 is a valid CAS Registry Number.

776-02-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-amino-1-[4-(trifluoromethyl)phenyl]ethanol

1.2 Other means of identification

Product number -
Other names 2-hydroxy-2-(4-trifluoromethylphenyl)ethanamine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:776-02-3 SDS

776-02-3Relevant academic research and scientific papers

RORγ ANTAGONIST AND APPLICATION THEREOF IN MEDICINE

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Paragraph 00556, (2020/02/06)

Provided herein are compounds as RORγ antagonist having Formula (I). The compounds or pharmaceutical composition thereof can be used for regulating Retinoid-related orphan receptor gamma t (RORγt). Also provided herein are methods of preparation of the compounds and composition thereof, and uses thereof in treating or preventing RORγt mediated inflammation or autoimmune diseases in mammals, particularly humans.

DOPAMINE D3 RECEPTOR ANTAGONISTS HAVING A MORPHOLINE MOIETY

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Paragraph 0256, (2018/11/21)

The disclosure provides compounds of formula (I) or pharmaceutically acceptable salts thereof: The disclosure also provides processes for their preparation, intermediates used in these processes, pharmaceutical compositions containing them, and their use

NOVEL NON-SYSTEMIC TGR5 AGONISTS

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Page/Page column 79, (2018/02/28)

The present invention relates to tricyclic compounds of formula (I) and formula (II), or a pharmaceutically acceptable salt thereof. The present tricyclic compounds are useful non-sytemic TGR5 agonists that can be used to treat diabetic diseases in human. The present invention provides a pharmaceutical composition containing tricyclic compounds of formula (I) and formula (II) and a method of making as well as a method of using same in treating patients inflicted with metabolic disorders by administering same. The compounds of the present invention may be used in combination with additional anti-diabetic drugs.

Synthesis, molecular modelling and CYP24A1 inhibitory activity of novel of (E)-N-(2-(1H-imidazol-1-yl)-2-(phenylethyl)-3/4-styrylbenzamides

Taban, Ismail M.,Zhu, Jinge,DeLuca, Hector F.,Simons, Claire

supporting information, p. 4076 - 4087 (2017/07/05)

CYP24A1 (25-hydroxyvitamin D-24-hydroxylase) is a useful enzyme target for a range of medical conditions including cancer, cardiovascular and autoimmune disease, which show elevated CYP24A1 levels and corresponding reduction of calcitriol (the biologically active form of vitamin D). A series of (E)-N-(2-(1H-imidazol-1-yl)-2-(phenylethyl)-3/4-styrylbenzamides have been synthesised using an efficient synthetic route and shown to be potent inhibitors of CYP24A1 (IC50 0.11–0.35?μM) compared with the standard ketoconazole. Molecular modelling using our CYP24A1 homology model showed the inhibitors to fill the hydrophobic binding site, forming key transition metal interaction between the imidazole nitrogen and the haem Fe3+ and multiple interactions with the active site amino acid residues.

Direct catalytic synthesis of unprotected 2-amino-1-phenylethanols from alkenes by using iron(II) phthalocyanine

Legnani, Luca,Morandi, Bill

supporting information, p. 2248 - 2251 (2016/02/18)

Aryl-substituted amino alcohols are privileged scaffolds in medicinal chemistry and natural products. Herein, we report that an exceptionally simple and inexpensive FeII complex efficiently catalyzes the direct transformation of simple alkenes into unprotected amino alcohols in good yield and perfect regioselectivity. This new catalytic method was applied in the expedient synthesis of bioactive molecules and could be extended to aminoetherification.

Novel morpholine scaffolds as selective dopamine (DA) D3 receptor antagonists

Micheli, Fabrizio,Cremonesi, Susanna,Semeraro, Teresa,Tarsi, Luca,Tomelleri, Silvia,Cavanni, Paolo,Oliosi, Beatrice,Perdon, Elisabetta,Sava, Anna,Zonzini, Laura,Feriani, Aldo,Braggio, Simone,Heidbreder, Christian

, p. 1329 - 1332 (2016/02/23)

A new series of morpholine derivatives has been identified as selective DA D3 receptor antagonists; their in vitro profile and pharmacokinetic data are provided.

Catalyst development for organocatalytic hydrosilylation of aromatic ketones and ketimines

Malkov, Andrei V.,Stewart-Liddon, Angus J. P.,McGeoch, Grant D.,Ramirez-Lopez, Pedro,Kocovsky, Pavel

, p. 4864 - 4877 (2012/07/28)

A new family of Lewis basic 2-pyridyl oxazolines have been developed, which can act as efficient organocatalysts for the enantioselective reduction of prochiral aromatic ketones and ketimines with trichlorosilane, a readily available and inexpensive reagent. 1-Isoquinolyl oxazoline, derived from mandelic acid, was identified as the most efficient catalyst of the series, capable of delivering high enantioselectivities in the reduction of both ketones (up to 94% ee) and ketimines (up to 89% ee).

PYRIMDINE COMPOUNDS USEFUL AS KINASE INHIBITORS

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Page/Page column 45, (2010/11/30)

A compound of formula (I) or a salt or solvate thereof: Formula (1) compositions and medicaments containing the same, as well as processes for the preparation and use of such compounds, compositions and medicaments. Such mono-anilino pyrimidine derivative

Discovery and optimisation of potent, selective, ethanolamine inhibitors of bacterial phenylalanyl tRNA synthetase

Jarvest, Richard L.,Erskine, Symon G.,Forrest, Andrew K.,Fosberry, Andrew P.,Hibbs, Martin J.,Jones, Joanna J.,O'Hanlon, Peter J.,Sheppard, Robert J.,Worby, Angela

, p. 2305 - 2309 (2007/10/03)

High throughput screening of Staphylococcus aureus phenylalanyl tRNA synthetase (FRS) identified ethanolamine 1 as a sub-micromolar hit. Optimisation studies led to the enantiospecific lead 64, a single-figure nanomolar inhibitor. The inhibitor series shows selectivity with respect to the mammalian enzyme and the potential for broad spectrum bacterial FRS inhibition.

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