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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)-

3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-2-oxo-4-(trifluoromethyl)-

N#Cc1c(O)nc(cc1C(F)(F)F)O Request for Quotation
Chemical Name: 3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-2-oxo-4-(trifluoromethyl)-
CAS Number: 3335-46-4
Product Number: AG003G4P(AGN-PC-0O90RT)
Synonyms:
MDL No:
Molecular Formula: C7H3F3N2O2
Molecular Weight: 204.1061

Identification/Properties

Properties
MP:
285 °C
BP:
582.2°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
204.108g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
204.015g/mol
Monoisotopic Mass:
204.015g/mol
Topological Polar Surface Area:
73.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
397
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


2,6-Dihydroxy-4-(trifluoromethyl)nicotinonitrile, a versatile chemical compound, plays a crucial role in chemical synthesis as a key building block for the creation of various complex molecules. With its unique structural properties, this compound is frequently utilized in the synthesis of pharmaceuticals, agrochemicals, and advanced materials.In pharmaceutical synthesis, 2,6-Dihydroxy-4-(trifluoromethyl)nicotinonitrile serves as a pivotal intermediate in the preparation of novel drug candidates due to its ability to participate in diverse chemical reactions. Its incorporation into drug molecules can enhance their potency, selectivity, and overall pharmacological properties.Additionally, in agrochemical synthesis, this compound finds application in the development of active ingredients for pesticides and herbicides. By leveraging its structural features, researchers can efficiently design environmentally friendly agrochemicals with improved efficacy and reduced ecological impact.Furthermore, in the realm of advanced materials, 2,6-Dihydroxy-4-(trifluoromethyl)nicotinonitrile is instrumental in the fabrication of specialty polymers, organic electronic materials, and functionalized surfaces. Its presence in the molecular structure imparts specific functionalities and performance characteristics to the final materials, enabling their use in cutting-edge applications such as sensors, catalysts, and optoelectronic devices.