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@ARTICLE{Scholz:9772,
author = {Scholz, R. and Hellmann, G. and Rohs, S. and Özdemir, D.
and Raabe, G. and Vermeeren, C. and Gais, H.-J.},
title = {{E}nantioselective {S}ynthesis, {C}onfigurational
{S}tability, and {R}eactivity of {L}ithium
a-tert-{B}utylsulfonyl {C}arbanion {S}alts},
journal = {European journal of organic chemistry},
volume = {2010},
issn = {1434-193X},
address = {Weinheim},
publisher = {Wiley-VCH Verl.},
reportid = {PreJuSER-9772},
pages = {4588 - 4616},
year = {2010},
note = {This research was supported by the Deutsche
Forschungsgemeinschaft (DEG), Volkswagen Foundation, and
Fonds der Chemischen Industrie. We thank D. Wolters for his
help with the graphics.},
abstract = {The reactions of enantiopure S-tert-butyl sulfones of the
type (RCH)-C-I(R-2)SO(2)tBu (<= 99 $\%$ ee) with
lithiumorganyl compounds gave the corresponding chiral
alpha-sulfonyl carbanion salts [(RC)-C-1(R-2)SO(2)tBu]Li
with >= 94 $\%$ ee. The enantioselectivity of the
deprotonation of the phenyl-but not dialkyl-substituted
sulfones is strongly dependent on the nature of the
lithiumorganyl. Because of this observation and the strong
decrease in enantioselectivity in the presence of TMEDA and
HMPA, we propose an intramolecular proton transfer following
complexation of the sulfone by RLi. Racemization of
(RC)-C-1(R(2))SO(2)tBu]Li follows first-order kinetics and
seems to be mainly an enthalpic process with a small
negative activation entropy, as revealed by polarimetric
measurements at low temperatures. This is in accordance with
C-alpha-S bond rotation as the rate-determining step. The
salts [(RC)-C-1(R-2)SO(2)tBu]Li have half-lives of
racemization in the order of several hours at -105 degrees
C. The deuteriation of the salts at -105 degrees C with
CF3CO2D proceeded with enantioselectivities of >= 94 $\%$
ee, the magnitude of which was not significantly affected by
the presence of TMEDA and HMPA. The salts also reacted with
carbon-based electrophiles at low temperatures with high
enantioselectivity. The conversion of (RCH)-C-1(R-2)SO(2)tBu
via [(RC)-C-1(R-2)SO(2)tBu]Li to (RC)-C-1(R-2,E)SO(2)tBu,
which involves the loss of stereogenicity at the
alpha-stereogenic center and its reestablishment upon
reaction of the chiral carbanian with electrophiles,
occurred with high overall enantioselectivity. Electrophiles
attack the anionic C atom of [(RC)-C-1(R-2)SO(2)tBu]Li with
high selectivity on the side syn to the O atoms and anti to
the tert-butyl group. The reactivity of the
dialkyl-substituted salts [(RC)-C-1(R-2)SO(2)tBuiLi (R-1,
R-2 = alkyl) is significantly higher than that of the
benzylic salts [RC(Ph)SO(2)tBu]Li (R = alkyl) and the
HMPA-coordinated SIPs of [MeC(Ph)SO(2)tBu]Li are
significantly more reactive towards EtI than the
corresponding O-Li contact ion pairs.},
keywords = {J (WoSType)},
cin = {IEK-7},
ddc = {540},
cid = {I:(DE-Juel1)IEK-7-20101013},
pnm = {Atmosphäre und Klima},
pid = {G:(DE-Juel1)FUEK491},
shelfmark = {Chemistry, Organic},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000281723200005},
doi = {10.1002/ejoc.201000410},
url = {https://juser.fz-juelich.de/record/9772},
}