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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)-

Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate

CCOC(=O)c1cc(n(n1)C)C(F)(F)F Request for Quotation
Chemical Name: Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate
CAS Number: 852228-09-2
Product Number: AG00GM0B(AGN-PC-0WAXYX)
Synonyms:
MDL No: MFCD18262320
Molecular Formula: C8H9F3N2O2
Molecular Weight: 222.1645

Identification/Properties

Computed Properties
Molecular Weight:
222.167g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
222.062g/mol
Monoisotopic Mass:
222.062g/mol
Topological Polar Surface Area:
44.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
245
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate is a versatile compound commonly used in chemical synthesis due to its unique structure and reactivity. This compound serves as a valuable building block in the creation of various pharmaceuticals, agrochemicals, and functional materials. Its trifluoromethyl group provides enhanced lipophilicity and metabolic stability to the final products, making it particularly useful in drug development. Additionally, the pyrazole ring moiety offers opportunities for further functionalization, allowing chemists to tailor the compound for specific applications. In synthesis, Ethyl 1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylate acts as a key intermediate in the formation of more complex molecules, enabling the efficient and controlled construction of advanced chemical structures. By leveraging the unique properties of this compound, researchers can efficiently access a wide range of novel compounds with diverse applications in various industries.