Liu, Michael T. H., and J. E. Chateauneuf. “Spectroscopic Detection of an Arylchlorocarbene-Ethyl Acetate Carbonyl Ylide and Subsequent Oxirane Formation”. Journal of the American Chemical Society, vol. 113, no. 17, 1991, pp. 6585-8, https://doi.org/10.1021/ja00017a033.

Genre

  • Journal Article
Contributors
Author: Liu, Michael T. H.
Author: Chateauneuf, J. E.
Date Issued
1991
Abstract

Laser flash photolysis of 3-chloro-3-(p-nitrophenyl)diazirine (1) generates the corresponding ground-state singlet carbene (lambda-max = 310 nm), which reacts with ethyl acetate to form a carbonyl ylide of the ester (lambda-max = 490 nm). The absolute rate constant for ylide formation in CH2Cl2 is k = (2.85 +/- 0.17) X 10(6) M-1 s-1. Subsequent cyclization of the ylide to the corresponding oxirane (lambda-max = 350 nm) occurs with a rate constant of 1.26 x 10(6) S-1 (21-degrees-C) in ethyl acetate with Arrhenius activation parameters for oxirane formation of E(act) = 6.68 +/- 0.19 kcal/mol and log A (s-1) = 11.08 +/- 0.15. The carbonyl ylide is also intercepted with the dipolarophile, diethyl fumarate, with a rate constant of (1.04 +/- 0.07) x 10(7) M-1 s-1. Additionally, solvent polarity effects on (p-nitrophenyl)chlorocarbene reactivity and spectroscopic evidence of oxirane formation (lambda-max = 350 nm) from the related acetone ylide of (p-nitrophenyl)chlorocarbene are presented.

Note

UNIV PRINCE EDWARD ISL,DEPT CHEM,CHARLOTTETOWN C1A 4P3,PEI,CANADA.; CHATEAUNEUF, JE, UNIV NOTRE DAME,RADIAT LAB,NOTRE DAME,IN 46556.

WASHINGTON; 1155 16TH ST, NW, WASHINGTON, DC 20036

AMER CHEMICAL SOC

PT: J; CR: BONNEAU R, 1989, J CHEM SOC CHEM COMM, P510 BONNEAU R, 1990, J AM CHEM SOC, V112, P744 IBATA T, 1987, CHEM LETT, V28, P2135 LIU MTH, 1972, CAN J CHEM, V50, P3009 LIU MTH, 1987, TETRAHEDRON LETT, V28, P1011 LIU MTH, 1990, J CHEM SOC CHEM COMM, P1482 NAGARAJAN V, 1985, J PHYS CHEM-US, V89, P2330 PAUL H, 1978, J AM CHEM SOC, V100, P4520 PLATZ MS, COMMUNICATION REICHARDT C, 1988, SOLVENTS SOLVENT EFF, P352 SOUNDARARAJAN N, 1988, J AM CHEM SOC, V110, P7143 SOUNDARARAJAN N, 1988, TETRAHEDRON LETT, V29, P3419; NR: 12; TC: 14; J9: J AMER CHEM SOC; PG: 4; GA: GB298

Source type: Electronic(1)

Language

  • English

Subjects

  • FLASH-PHOTOLYSIS
  • Kinetics
  • ACETONE
  • Chemistry, Multidisciplinary
  • PARA-NITROPHENYLCHLOROCARBENE
  • RADICALS
Page range
6585-6588
Host Title
Journal of the American Chemical Society
Host Abbreviated Title
J.Am.Chem.Soc.
Volume
113
Issue
17
ISSN
0002-7863

Department