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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

5-Methyl-3-trifluoromethyl-1H-pyrazole

FC(c1cc([nH]n1)C)(F)F Request for Quotation
Chemical Name: 5-Methyl-3-trifluoromethyl-1H-pyrazole
CAS Number: 942060-04-0
Product Number: AG00GUQ2(AGN-PC-0JMQJJ)
Synonyms:
MDL No:
Molecular Formula: C5H5F3N2
Molecular Weight: 150.1018

Identification/Properties

Computed Properties
Molecular Weight:
150.104g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
150.04g/mol
Monoisotopic Mass:
150.04g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
123
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The compound 5-Methyl-3-(trifluoromethyl)-1H-pyrazole is a versatile building block in chemical synthesis due to its unique structural properties and reactivity. It can be utilized as a key intermediate in the preparation of various pharmaceuticals, agrochemicals, and functional materials.In organic synthesis, 5-Methyl-3-(trifluoromethyl)-1H-pyrazole can serve as a valuable starting material for the construction of heterocyclic compounds. Its trifluoromethyl group imparts enhanced lipophilicity and metabolic stability to the final products, making it an attractive moiety for drug design and discovery.Furthermore, the presence of the methyl group at the 5-position of the pyrazole ring allows for further derivatization through various chemical reactions such as substitution, oxidation, and reduction. This flexibility in functional group manipulation enables the synthesis of a wide range of structurally diverse molecules with potential biological activities.Overall, the use of 5-Methyl-3-(trifluoromethyl)-1H-pyrazole in chemical synthesis offers synthetic chemists a valuable tool for the efficient and strategic construction of complex organic compounds with potential applications in the pharmaceutical and agrochemical industries.