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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)-

1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde

O=Cc1cc(nn1C1CCCCO1)C(F)(F)F Request for Quotation
Chemical Name: 1-(Oxan-2-yl)-3-(trifluoromethyl)pyrazole-5-carboxaldehyde
CAS Number: 1437794-28-9
Product Number: AG001ICF(AGN-PC-0WA3YR)
Synonyms:
MDL No:
Molecular Formula: C10H11F3N2O2
Molecular Weight: 248.2017

Identification/Properties

Computed Properties
Molecular Weight:
248.205g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
248.077g/mol
Monoisotopic Mass:
248.077g/mol
Topological Polar Surface Area:
44.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
285
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-(Tetrahydro-2H-pyran-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carbaldehyde is a versatile compound widely used in chemical synthesis. Its unique structure allows it to serve as a key building block in the development of various organic molecules and pharmaceuticals. In particular, this compound has shown promising results in the synthesis of complex heterocyclic compounds due to its ability to participate in a variety of important chemical reactions.In organic synthesis, 1-(Tetrahydro-2H-pyran-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carbaldehyde can be utilized as a starting material for the construction of diverse molecular structures through functional group transformations and derivatizations. Its trifluoromethyl and aldehyde functional groups are especially valuable in introducing specific properties and functionalities into target molecules. Additionally, the pyrazole ring provides a scaffold for further modifications, enabling the creation of novel chemical entities with potential applications in drug discovery and materials science.Overall, the strategic incorporation of 1-(Tetrahydro-2H-pyran-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carbaldehyde into synthetic schemes enables chemists to access valuable intermediates and final products with enhanced structural diversity and desirable properties.