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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)-

4-chloro-1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrrolo[2,3-b]pyridine

Cc1ccc(cc1)S(=O)(=O)n1cc(c2c1nccc2Cl)C(F)(F)F Request for Quotation
Chemical Name: 4-chloro-1-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrrolo[2,3-b]pyridine
CAS Number: 869335-74-0
Product Number: AG004I4Y(AGN-PC-00E6IV)
Synonyms:
MDL No:
Molecular Formula: C15H10ClF3N2O2S
Molecular Weight: 374.7653

Identification/Properties

Properties
BP:
484.67°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
374.762g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
374.01g/mol
Monoisotopic Mass:
374.01g/mol
Topological Polar Surface Area:
60.3A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
558
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Chloro-1-tosyl-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine is a versatile compound that finds wide application in chemical synthesis. It serves as a key building block in the creation of various organic molecules with unique properties and functionalities. With its strategic positioning of a chloro, tosyl, and trifluoromethyl group on a pyrrolopyridine scaffold, this compound acts as a valuable intermediate in the synthesis of pharmaceuticals, agrochemicals, and materials.In chemical synthesis, 4-Chloro-1-tosyl-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine participates in numerous reactions, such as nucleophilic substitutions, palladium-catalyzed cross-coupling reactions, and functional group transformations. Its chloro group enables further derivatization through substitution reactions, leading to the introduction of various functional groups for fine-tuning the properties of the final product. The tosyl group serves as a leaving group in displacement reactions, facilitating the formation of new carbon-carbon or carbon-heteroatom bonds. Additionally, the trifluoromethyl group contributes to the compound's enhanced lipophilicity and bioactivity in target molecules.Overall, 4-Chloro-1-tosyl-3-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine plays a crucial role in the synthesis of diverse chemical compounds by providing a platform for the introduction of specific functional groups and structural motifs. Its strategic design and reactivity make it a valuable tool for organic chemists in the rational design and development of novel compounds for various applications.