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Merck
CN

708844

(1S,2S)-N,N′-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato cobalt(II)

Synonym(s):

(S,S)-AMAC

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About This Item

Empirical Formula (Hill Notation):
C32H38CoN2O4
CAS Number:
Molecular Weight:
573.59
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352000
MDL number:
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InChI

1S/C32H40N2O4.Co/c1-17-11-19(3)29(20(4)12-17)31(33-15-27(23(7)35)24(8)36)32(34-16-28(25(9)37)26(10)38)30-21(5)13-18(2)14-22(30)6;/h11-16,31-32,35,37H,1-10H3;/q;+2/p-2/b27-23+,28-25+,33-15+,34-16+;/t31-,32-;/m0./s1

SMILES string

CC(=O)C1=C(C)O[Co]OC(C)=C(\C=N\[C@H]([C@@H](\N=C\1)c2c(C)cc(C)cc2C)c3c(C)cc(C)cc3C)C(C)=O

InChI key

PHCQQLMRNZRDJA-OZXAGROVSA-L

form

solid

optical activity

[α]/D −309°, c = 0.1 in chloroform

mp

242-246 °C

functional group

ketone

Quality Level

Application

Catalyst for:
  • Stereoselective preparation of benzylic alcohols via oxidative kinetic resolution of secondary benzylic alcohols with oxygen in presence of alkene
  • Enantioselective borohydride reduction
  • Preparation of ß-nitro alcohols from aldehydes and nitroalkanes by stereoselective Henry reaction in presence of amine bases
  • Preparation of optically pure diarylpropanediols via reduction of the corresponding diketones

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)


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