2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol

Basic Information

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CAS Number

96145-98-1

Molecular Formula

C10H7F3N2O

Molecular Weight

228.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

318.4°C at 760 mmHg

SMILES

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C1=CC=C(C=C1)N2C(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C10H7F3N2O/c11-10(12,13)8-6-9(16)15(14-8)7-4-2-1-3-5-7/h1-6,16H

InChIKey

CGMKIOXMUMZDAP-UHFFFAOYSA-N

LogP

2.5967000000000002

Topological Polar Surface Area

38.050000000000004 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

319

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol
5-Hydroxy-1-phenyl-3-trifluoromethylpyrazole
1-phenyl-3-trifluoromethyl-5-hydroxypyrazole
2-Phenyl-5-trifluoro
1-Phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ol
5-Hydroxy-1-phenyl-3-(trifluoromethyl)-1H-pyrazole
1-phenyl-3-[trifluoromethyl]-1h-pyrazol-5-ol
2-phenyl-5-(trifluoromethyl)pyrazol-3-ol
Maybridge1_004315
1H-Pyrazol-5-ol, 1-phenyl-3-(trifluoromethyl)-
HMS553M05
PSQCMVQGPMFFCX-UHFFFAOYSA-N
CGMKIOXMUMZDAP-UHFFFAOYSA-N
HMS1590E01
STK
1-Phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ol (ACI)
1-Phenyl-3-trifluoromethyl-1H-pyrazol-5-ol
1-Phenyl-3-trifluoromethyl-5-hydroxypyrazole
Phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ol
DTXSID60358397
2-phenyl-5-(trifluoromethyl)-2,3-dihydro-1H-pyrazol-3-one
CS-0040063
1-phenyl-3-trifluoromethyl-1H-pyrazol-5-ol
SCHEMBL486072
2-phenyl-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
AKOS000310728
NS00016418
1H-Pyrazol-5-ol,1-phenyl-3-(trifluoromethyl)-
AC-26699
BBL039000
CS-10775

MDL Number

MFCD03714773

Customs Code

2933199090

FAQ

What regulatory guidelines apply to 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1)?

2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) is subject to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes health, environmental, and physical hazard classifications. In the European Union, it is also regulated under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulation. Additionally, the U.S. Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) may have specific requirements for its handling, storage, and disposal due to its chemical properties.

Are there alternatives to 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) in synthesis?

There are several alternatives to 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) in synthesis, including analogs such as 2-Phenyl-2H-pyrazol-3-ol and 2-Methyl-5-trifluoromethyl-2H-pyrazol-3-ol. Common alternative reagents include trifluoromethylated pyridines and other trifluoromethyl-derivatized aromatic compounds, which can serve as precursors or substitution targets in various chemical reactions.

What is the market or research trend for 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1)?

The market for 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) is experiencing steady growth due to its application in pharmaceuticals, agrochemicals, and materials science. Research trends focus on its potential as a bioisostere for drug development, particularly in antibacterial and antiviral agents. Additionally, there is increasing interest in its synthesis and modification for use in advanced materials and functional polymers.

How should waste containing 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) be handled?

Waste containing 2-Phenyl-5-trifluoromethyl-2H-pyrazol-3-ol (CAS: 96145-98-1) should be collected and stored in appropriate containers to prevent leaks or spills. Proper incineration is recommended for disposal, with necessary precautions taken to manage the high reactivity and potential for toxic fumes. Alternatively, professional waste disposal services can handle the waste safely, ensuring compliance with local and international regulations regarding hazardous waste management and disposal.