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390766-89-9

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390766-89-9 Structure

390766-89-9 Structure
IdentificationBack Directory
[Name]

(2R,5R)-(+)-2-TERT-BUTYL-3-METHYL-5-BENZYL-4-IMIDAZOLIDINONE
[CAS]

390766-89-9
[Synonyms]

MacMillan catalyst
MACMILLAN ORGANOCATALYST(TM) RR246
(2R,5R)-2-TERT-BUTYL-3-METHYL-5-BENZYL-&
(2R,5R)-5-benzyl-2-(tert-butyl)-3-methylimidazolidin-4-one
(2R,5R)-2-T-BUTYL-3-METHYL-5-PHENYLMETHYL-4-IMIDAZOLIDINONE
(2R,5R)-(+)-2-TERT-BUTYL-3-METHYL-5-BENZYL-4-IMIDAZOLIDINONE
(2R,5R)-(+)-5-Benzyl-2-tert-butyl-3-methyl-4-imidazolidinone
(2R,5R)-2-TERT-BUTYL-3-METHYL-5-PHENYLMETHYL-4-IMIDAZOLIDINONE
(2R,5R)-(+)-2-tert-Butyl-3-Methyl-5-benzyl-4-iMidazolidinone 97%
4-Imidazolidinone, 2-(1,1-dimethylethyl)-3-methyl-5-(phenylmethyl)-, (2R,5R)-
(2R,5R)-(+)-2-tert-Butyl-3-methyl-5-benzyl-4-imidazolidinone,(2R,5R)-2-tert-Butyl-3-methyl-5-phenylmethyl-4-imidazolidinone
[Molecular Formula]

C15H22N2O
[MDL Number]

MFCD08276842
[MOL File]

390766-89-9.mol
[Molecular Weight]

246.35
Chemical PropertiesBack Directory
[Melting point ]

93-100°C
[Boiling point ]

378.0±35.0 °C(Predicted)
[density ]

1.040±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

5.59±0.60(Predicted)
[color ]

White to Light yellow
[InChI]

1S/C15H22N2O/c1-15(2,3)14-16-12(13(18)17(14)4)10-11-8-6-5-7-9-11/h5-9,12,14,16H,10H2,1-4H3/t12-,14-/m1/s1
[InChIKey]

SKHPYKHVYFTIOI-TZMCWYRMSA-N
[SMILES]

CN1[C@@H](N[C@H](Cc2ccccc2)C1=O)C(C)(C)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P302+P352-P304+P340-P305+P351+P338
[WGK Germany ]

3
[HS Code ]

2933.29.9000
[Storage Class]

13 - Non Combustible Solids
Hazard InformationBack Directory
[Uses]

Used in the 1,4-addition of electron-rich benzenes to unsaturated aldehydes, and the asymmetric hydride reduction of α,β-unsaturated aldehydes.
[General Description]

(2R,5R)-(+)-2-tert-Butyl-3-methyl-5-benzyl-4-imidazolidinone is a chiral imidazolidinone organocatalyst, developed by MacMillan and co-workers.
Spectrum DetailBack Directory
[Spectrum Detail]

(2R,5R)-(+)-2-TERT-BUTYL-3-METHYL-5-BENZYL-4-IMIDAZOLIDINONE(390766-89-9)1HNMR
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