Publications

451. Day, C.S.; Fawcett, A.; Chatterjee, R.; Hartwig, J.F. Mechanistic Investigation of the Iron-Catalyzed Azidation of Alkyl C(sp³ )−H Bonds with Zhdankin’s λ³ Azidoiodane. J. Am. Chem. Soc. 2021, 143, 16184-16196.

449. Fuentes, M. A.; Gava, R.; Saper, N. I.; Romero, E.; Caballero, A.; Hartwig, J. F.; Pérez, P. J. Copper-Catalyzed Dehydrogenative Amidation of Light Alkanes. Angew. Chem. Int. Ed. 2021, 60, 18467-18471.

447. Fawcett, A.; Keller, M.J.; Herrera, Z.; Hartwig, J.F. Site Selective Chlorination of C(sp³)-H Bonds Suitable for Late-Stage Functionalization. Angew. Chem. Int. Ed. 2021, 60, 8276-8283.

443. Tlahuext-Aca, A.; Lee, S. Y.; Sakamoto, S.; Hartwig, J.F. Direct Arylation of Simple Arenes with Aryl Bromides by Synergistic Silver and Palladium Catalysis. ACS Catal. 2021, 11, 1430-1434.

442. Tlahuext-Aca, A.; Hartwig, J.F. Site-Selective Silver-Catalyzed C–H Bond Deuteration of Five-Membered Aromatic Heterocycles and Pharmaceuticals. ACS Catal. 2021, 11, 1119-1127.

439. Qiu, Y.; Hartwig, J.F. Mechanism of Ni-Catalyzed Oxidations of Unactivated C(sp³)–H Bonds. J. Am. Chem. Soc. 2020, 142, 19239-19248.

437. Oeschger, R.; Su, B.; Yu, I.; Ehinger, C.; Romero, E.; He, S.; Hartwig, J.F. Diverse functionalization of strong alkyl C–H bonds by undirected borylation. Science 2020, 368, 736-741.

428. Karmel, C.; Hartwig, J.F. Mechanism of the Iridium-Catalyzed Silylation of Aromatic C–H Bonds. J. Am. Chem. Soc. 2020, 142, 10494-10505.

425. Su, B; Bunescu, A.; Qiu, Y.; Zuend, S.J.; Ernst, M.; Hartwig, J.F. Palladium-Catalyzed Oxidation of β-C(sp³)–H Bonds of Primary Alkylamines through a Rare Four-Membered Palladacycle Intermediate. J. Am. Chem. Soc. 2020, 142, 7912-7919.

423. Larsen, M.A.; Oeschger, R.J.; Hartwig, J.F. Effect of Ligand Structure on the Electron Density and Activity of Iridium Catalysts for the Borylation of Alkanes. ACS Catal. 2020, 10, 3415-3424.

420. Karmel, C.; Rubel, C.Z.; Kharitonova, E.V.; Hartwig, J.F. Iridium‐Catalyzed Silylation of Five‐Membered Heteroarenes: High Sterically Derived Selectivity from a Pyridyl‐Imidazoline Ligand. Angew. Chem. Int. Ed. 2020, 59, 6074-6081.

418. Oeschger, R.J.; Larsen, M.A.; Bismuto, A.; Hartwig, J.F. Origin of the Difference in Reactivity between Ir Catalysts for the Borylation of C-H Bonds. J. Am. Chem. Soc. 2019, 141, 16479-16485.

408. He, Z.T., Hartwig, J.F. Palladium-Catalyzed α-Arylation of Carboxylic Acids and Secondary Amides via a Traceless Protecting Strategy. J. Am. Chem. Soc. 2019, 141, 11749-11753.

407. Hartwig, J.F., Romero, E.A. Iridium-catalyzed silylation of unactivated C-H bonds. Tetrahedron 2019, 75, 4059-4070.

406. Karmel, C., Chen, Z., Hartwig, J.F. Iridium-Catalyzed Silylation of C–H Bonds in Unactivated Arenes: A Sterically Encumbered Phenanthroline Ligand Accelerates Catalysis. J. Am. Chem. Soc. 2019, 141, 7063-7072.

372. Jin, Y.; Chen, M.; Ge, S.; Hartwig, J.F. Palladium-Catalyzed, Enantioselective α‑Arylation of α‑Fluorooxindoles. Org. Lett. 2017, 19, 1390–1393.

371. Litman, Z.C.; Sharma, A.; Hartwig, J.F. Oxidation of Hindered Allylic C-h Bonds with Applications to the Functionalization of Complex Molecules. ACS Catal. 2017, 7, 1998-2001.

367. Su, B.; Zhou, T.; Li, X.; Shao, X.; Xu, P.; Wu, W.; Hartwig, J.F.; Shi, Z. A Chiral Nitrogen Ligand for Enantioselective, Iridium-Catalyzed Silylation of Aromatic C-H Bonds. Angew. Chem. Int. Ed. 2017, 56, 1092–1096.

363. Karimov, R.R.; Sharma, A.; Hartwig, J.F. Late Stage Azidation of Complex Molecules. ACS Cent. Sci. 2016, 2, 715-724.

354. Lee, T.; Hartwig, J.F. Rhodium-Catalyzed Enantioselective Silylation of Cyclopropyl C-H Bonds. Angew. Chem. Int. Ed. 2016, 55, 8723-8727.

347. Larsen, M.A.; Cho, S.H.; Hartwig, J.F. Iridium-Catalyzed, Hydrosilyl-Directed Borylation of Unactivated Alkyl C–H Bonds. J. Am. Chem. Soc. 2016, 138, 762-765.

339. Larsen, M.A.; Wilson, C.V.; Hartwig, J.F. Iridium-Catalyzed Borylation of Primary Benzylic C–H Bonds without a Directing Group: Scope, Mechanism, and Origins of Selectivity. J. Am. Chem. Soc. 2015, 137, 8633-8643.

335. Lee, T.; Wilson, T.W.; Berg, R.; Ryberg, P.; Hartwig, J.F. Rhodium-Catalyzed Enantioselective Silylation of Arene C-H bonds: Desymmetrization of Diarylmethanols. J. Am. Chem. Soc. 2015, 137, 6742-6745.

333. Cheng, C.; Hartwig, J.F. Iridium-Catalyzed Silylation of Aryl C−H Bonds. J. Am. Chem. Soc. 2015, 137, 592-595.

331. Sharma, A.; Hartwig, J.H. Metal-Catalyzed Azidation of Tertiary C–H Bonds Suitable for Late-Stage Functionalization. Nature 2015, 517, 600-604.

330. Tran, B. L.; Driess, M.; Hartwig, J. F. Copper-Catalyzed Oxidative Dehydrogenative Carboxylation of Unactivated Alkanes to Allylic Esters via Alkenes. J. Am. Chem. Soc. 2014, 136, 17292-17301.

325. Cheng, C.; Hartwig, J.F. Mechanism of the Rhodium-Catalyzed Silylation of Arene C−H Bonds. J. Am. Chem. Soc. 2014, 136, 12064-12072.

323. Fier, P.S.; Hartwig, J.F. Synthesis and Late-Stage Functionalization of Complex Molecules through C−H Fluorination and Nucleophilic Aromatic Substitution. J. Am. Chem. Soc. 2014, 136, 10139-10147.

321. Li, B.; Driess, M.; Hartwig, J.F. Iridium-Catalyzed Regioselective Silylation of Secondary Alkyl C−H Bonds for the Synthesis of 1,3-Diols. J. Am. Chem. Soc. 2014, 136, 6586-6589.

320. Li, Q.; Driess, M.; Hartwig, J.F. Iridium-Catalyzed Regioselective Silylation of Aromatic and Benzylic C-H Bonds Directed by a Secondary Amine. Angew. Chem. Int. Ed. 2014, 53, 1-5.

319. Li, Q.; Liskey, C.W.; Hartwig, J.F. Regioselective Borylation of the C–H Bonds in Alkylamines and Alkyl Ethers. Observation and Origin of High Reactivity of Primary C–H Bonds Beta to Nitrogen and Oxygen. J. Am. Chem. Soc. 2014, 136, 8755–8765.

316. Cho, S.H.; Hartwig, J.F. Iridium-catalyzed diborylation of benzylic C–H bonds directed by a hydrosilyl group: synthesis of 1,1-benzyldiboronate esters. Chem. Sci. 2014, 5, 694-698.

315. Larsen, M.A.; Hartwig, J.F. Iridium-Catalyzed C−H Borylation of Heteroarenes: Scope, Regioselectivity, Application to Late-Stage Functionalization, and Mechanism. J. Am. Chem. Soc. 2014, 136, 4287-4299.

313. Cheng, C.; Hartwig, J.F. Rhodium-Catalyzed Intermolecular C–H Silylation of Arenes with High Steric Regiocontrol. Science. 2014, 343, 853-857.

311. Tran, B.L.; Li, B.; Driess, M.; Hartwig, J.F. Copper-Catalyzed Intermolecular Amidation and Imidation of Unactivated Alkanes. J. Am. Chem. Soc. 2014, 136, 2555-2563.

305. Fier, P.S.; Hartwig, J.F. Selective C-H Fluorination of Pyridines and Diazines Inspired by a Classic Amination Reaction. Science 2013, 342, 956-960.

300. Cheng, C.; Simmons, E.M.; Hartwig, J.H. Iridium-Catalyzed, Diastereoselective Dehydrogenative Silylation of Terminal Alkenes with (TMSO)2MeSiH. Angew. Chem. Int. Ed. 2013, 52, 8984 –8989.

297. Shrestha, R.; Mukherjee, P.; Tan, Y.; Litman, Z.C.; Hartwig, J.F. Sterically Controlled, Palladium-Catalyzed Intermolecular Amination of Arenes. J. Am. Chem. Soc. 2013, 135, 8480-8483.

296. Cho, S.H.; Hartwig, J.F. Iridium-Catalyzed Borylation of Secondary Benzylic C–H Bonds Directed by a Hydrosilane. J. Am. Chem. Soc. 2013, 135, 8157–8160.

295. Liskey, C.W.; Hartwig, J.F. Iridium-Catalyzed C–H Borylation of Cyclopropanes. J. Am. Chem. Soc. 2013, 135, 3375–3378.

291. Robbins, D.W.; Hartwig, J.F. Sterically Controlled Alkylation of Arenes through Iridium-Catalyzed C-H Borylation. Angew. Chem. Int. Ed. 2013, 52, 933–937.

290. Partridge, B.M.; Hartwig, J.F. Sterically Controlled Iodination of Arenes via Iridium-Catalyzed C-H Borylation. Org. Lett. 2013, 15, 140–143.

281. Robbins, D.W.; Hartwig, J.F. A C-H Borylation Approach to Suzuki-Miyaura Coupling of Typically Unstable 2-Heteroaryl and Polyfluorophenyl Boronates. Org. Lett. 2012, 14, 4266–4269.

280. Liskey, C.W.; Hartwig, J.F. Iridium-Catalyzed Borylation of Secondary C-H Bonds in Cyclic Ethers. J. Am. Chem. Soc. 2012, 134, 12422–12425.

274. Simmons, E.M.; Hartwig, J.F. Catalytic functionalization of unactivated primary C–H bonds directed by an alcohol. Nature 2012, 483, 70–73.

273. Tan, Y.; Barrios-Landeros, F; Hartwig, J.F. Mechanistic Studies on Direct Arylation of Pyridine N-Oxide: Evidence for Cooperative Catalysis between Two Distinct Palladium Centers. J. Am. Chem. Soc. 2012, 134, 3683–3686.

262. Tan, Y.; Hartwig, J. F. Assessment of the Intermediacy of Arylpalladium Carboxylate Complexes in the Direct Arylation of Benzene: Evidence for C-H Bond Cleavage by ‘Ligandless’ Species. J. Am. Chem. Soc 2011, 133, 3308-3311.

249. Liskey, C.W.; Xuebin Liao, X.; Hartwig, J.F. Cyanation of Arenes via Iridium-Catalyzed Borylation. J. Am. Chem. Soc. 2010, 132, 11389-11391.

244. Robbins, D.W.; Boebel, T. A.; Hartwig, J.F. Iridium-Catalyzed, Silyl-Directed Borylation of Nitrogen-Containing Heterocycles. J. Am. Chem. Soc. 2010, 132, 4068-4069.

243. Tan, Y.; Hartwig, J.F. Palladium-Catalyzed Amination of Aromatic C–H Bonds with Oxime Esters. J. Am. Chem. Soc. 2010, 132, 3676-3677.

241. Sawyer, K.R., Cahoon, J.F., Shanoski, J.E., Glascoe, E.A., Kling, M.F., Schlegel, J.P., Zoerb, M.C., Hapke, M., Hartwig, J.F., Webster, C.E., Harris, C.B. Time-resolved IR Studies on the Mechanism for the Functionalization of Primary C−H Bonds by Photoactivated Cp*W(CO)3(Bpin). J. Am. Chem. Soc. 2010, 132, 1848-1859.

240. Wei, C.S.; Jiménez-Hoyos, C.A.; Videa, M.F.; Hartwig, J.F.; Hall, M.B. Origins of the Selectivity for Borylation of Primary over Secondary C–H Bonds Catalyzed by Cp*-Rhodium Complexes. J. Am. Chem. Soc. 2010, 132, 3078-3091.

238. Mkhalid, I.A.I.; Barnard, J.H.; Marder, T.B.; Murphy, J.M.; Hartwig, J.F. C-H Activation for the Construction of C-B Bonds. Chem. Rev. 2010, 110, 890-931.

233. Liskey, C.W., Wei, C.S., Pahls, D.R., Hartwig J.F. Pronounced Effects of Substituents on the Iridium-Catalyzed Borylation of Aryl C–H Bonds. Chem. Commun. 2009, 0, 5603-5605.

223. Zhou, J.; Hartwig, J.F. Iridium-Catalyzed H/D Exchange at Vinyl Groups without Olefin Isomerization. Angew. Chem. Int. Ed. 2008, 47, 5783-5787.

220. Boebel, T.A.; Hartwig, J.F. Conversion of 1,3-Disubstituted Arenes to Chiral α,α-Diaryl Methylammonium Chlorides Using Arene Borylation. Tetrahedron 2008, 64, 6824-6830.

218. Herzon, S.B.; Hartwig, J.F. Hydroaminoalkylation of Unactivated Olefins with Dialkylamines. J. Am. Chem. Soc. 2008, 130, 14940–14941.

202. Boebel, T.A. and J.F. Hartwig Silyl-Directed, Iridium-Catalyzed ortho-Borylation of Arenes. A One-Pot ortho-Borylation of Phenols, Arylamines, and Alkylarenes.. J. Am. Chem. Soc. 2008, 130, 7534-7535.

200. Murphy, J.M., Liao, X., and J. F. Hartwig Meta Halogenation of 1,3-Disubstituted Arenes via Iridium-Catalyzed Arene Borylation.. J. Am. Chem. Soc. 2007, 129, 15434-15435.

181. Murphy, J. M., Lawrence, J. D., Kawamura, K., Incarvito, C., and J. F. Hartwig Ruthenium-Catalyzed Regiospecific Borylation of Methyl C-H Bonds. J. Am. Chem. Soc. 2006, 128, 13684-13685.

162. Boller, T. M., Murphy, J. M., Hapke, M., Ishiyama, T., Miyaura, N., and J. F. Hartwig Mechanism of the Mild Functionalization of Arenes by Diboron Reagents Catalyzed by Iridium Complexes. Intermediacy and Chemistry of Bipyridine-Ligated Iridium Trisboryl Complexes. J. Am. Chem. Soc. 2005, 127, 14263-14278.

159. Hartwig, J. F., Cook, K. S., Hapke, M., Incarvito, C. D., Fan, Y., Webster, C. E., and M. B. Hall Rhodium Boryl Complexes in the Catalytic, Terminal Functionalization of Alkanes. J. Am. Chem. Soc. 2005, 127, 2538-2552.

152. Tsukada, N. and J. F. Hartwig Intermolecular and Intramolecular, Platinum-Catalyzed, Acceptorless Dehydrogenative Coupling of Hydrosilanes with Aryl and Aliphatic Methyl C-H Bonds. J. Am. Chem. Soc. 2005, 127, 5022-5023.

141. Lawrence, J. D., Takahashi, M., Bae, C. and J. F. Hartwig Regiospecific Functionalization of Methyl C-H Bonds of Alkyl Groups in Reagents with Heteroatom Functionality. J. Am. Chem. Soc. 2004, 126, 15334-15335.

123. Ishiyama, T., Takagi, J., Yonekawa, Y., Hartwig, J. F., and N. Miyaura Iridium-Catalyzed Direct Borylation of Five-Membered Heteroarenes by Bis(pinacolato)diboron: Regioselective, Stoichiometric, and Room Temperature Reactions. Advanced Synthesis and Catalysis 2003, 345, 1103-1106.

122. Ishiyama, T., Nobuta, Y., Hartwig, J. F., and N. Miyaura Room Temperature Borylation of Arenes and Heteroarenes Using Stoichiometric Amounts of Pinacolborane Catalyzed by Iridium Complexes in an Inert Solvent.. Chemical Communications 2003, 23, 2924-2925.

109. Webster, C. E., Fan, Y., Hall, M. B., Kunz, D., and J. F. Hartwig Experimental and Computational Evidence for a Boron-Assisted, Sigma-Bond Metathesis Pathway for Alkane Borylation. J. Am. Chem. Soc. 2003, 125, 858-859.

100. Ishiyama, T., Takagi, J., Hartwig, J. F., and N. Miyaura A stoichiometric aromatic C-H borylation catalyzed by iridium(I)/2,2 '-bipyridine complexes at room temperature. Angew. Chem. Int. Ed. 2002, 41, 3056-3058.

99. Ishiyama, T., Takagi, J., Ishida, K., Miyaura, N., Anasrasi, N. R., and J. F. Hartwig Mild iridium-catalyzed borylation of arenes. High turnover numbers, room temperature reactions, and isolation of a potential intermediate. J. Am. Chem. Soc. 2002, 124, 390-391.

96. Kondo, Y., Garcia-Cuadrado, D., Hartwig, J. F., Boaen, N. K., Wagner, N. L. and A. M. Hillmyer Rhodium-catalyzed, regiospecific functionalization of polyolefins in the melt. J. Am. Chem. Soc. 2002, 124, 1164-1165.

86. Takagi, J., Sato, K., Hartwig, J. F., Ishiyama, T., and N. Miyaura Iridium-catalyzed C-H coupling reaction of heteroaromatic compounds with bis(pinacolato)diboron: regioselective synthesis of heteroarylboronates. Tetrahedron Letters 2002, 43, 5649-5651.

80. Kawamura, K. and J. F. Hartwig Isolated Ir(V) boryl complexes and their reactions with hydrocarbons. J. Am. Chem. Soc. 2001, 123, 8422-8423.

68. Chen, H. Y., Schlecht, S., Semple, T. C., and J. F. Hartwig Thermal, catalytic, regiospecific functionalization of alkanes. Science 2000, 287, 1995-1997.

62. Waltz, K. M. and J. F. Hartwig Functionalization of alkanes by isolated transition metal boryl complexes. J. Am. Chem. Soc. 2000, 122, 11358-11369.

61. Chen, H. Y. and J. F. Hartwig Catalytic, regiospecific end-functionalization of alkanes: Rhenium-catalyzed borylation under photochemical conditions. Angew. Chem. Int. Ed. 1999, 38, 3391-3393.

52. Waltz, K. M., Muhoro, C. N., and J. F. Hartwig C-H activation and functionalization of unsaturated hydrocarbons by transition-metal boryl complexes. Organometallics 1999, 18, 3383-3393.

28. Waltz, K. M. and J. F. Hartwig Selective functionalization of alkanes by transition-metal boryl complexes. Science 1997, 277, 211-213.

8. Waltz, K.M., He, X., Muhoro, C., and J. F. Hartwig Hydrocarbon Functionalization by Transition-Metal Boryls. J. Am. Chem. Soc. 1995, 117, 11357-11358.