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668540

(2S,5S)-(–)-5-Benzyl-3-methyl-2-(5-methyl-2-furyl)-4-imidazolidinone

95%

Synonym(s):

(2S,5S)-3-Methyl-2-(5-methyl-2-furanyl)-5-(phenylmethyl)-4-imidazolidinone

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About This Item

Empirical Formula (Hill Notation):
C16H18N2O2
CAS Number:
415678-40-9
Molecular Weight:
270.33
NACRES:
NA.22
PubChem Substance ID:
24884991
UNSPSC Code:
12352005
MDL number:
MFCD08457653
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Quality Segment

100

assay

95%

refractive index

n20/D 1.5598

functional group

phenyl

SMILES string

CN1[C@H](N[C@@H](Cc2ccccc2)C1=O)c3ccc(C)o3

InChI

1S/C16H18N2O2/c1-11-8-9-14(20-11)15-17-13(16(19)18(15)2)10-12-6-4-3-5-7-12/h3-9,13,15,17H,10H2,1-2H3/t13-,15-/m0/s1

InChI key

IQIMPHPFMHVWBZ-ZFWWWQNUSA-N

Application

Highly selective organocatalyst for the Diels-Alder reaction with simple α,β−unsaturated ketones.
Catalyst for:
  • Enantioselective organocatalytic transfer hydrogenation of cycloalkenones with tert-Bu Hantzsch ester as source of hydrogen
  • Alkylation of indoles with an α,β-disubstituted α,β-unsaturated aldehyde in the enantioselective preparation of a selective serotonin reuptake inhibitor
  • MacMillan reaction

Legal Information

U.S. Pat. 6,369,243 and related patents apply. For research purposes only.

pictograms

Skull and crossbones
GHS06

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

>230.0 °F

flash_point_c

> 110 °C

ppe

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

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