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131833-93-7

131833-93-7 Structure

131833-93-7 Structure
IdentificationMore
[Name]

(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE)
[CAS]

131833-93-7
[Synonyms]

2,2'-ISOPROPYLIDENEBIS[(4S)-4-TERT-BUTYL-2-OXAZOLINE]
(S,S)-(-)-2,2-BIS(4-TERT-BUTYL-2-OXAZOLIN-2-YL)PROPANE
(S,S)-(-)-2,2'-(DIMETHYLMETHYLENE)BIS(4-TERT-BUTYL-2-OXAZOLINE)
(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE)
(S,S)-2,2'-ISOPROPYLIDENE-BIS(4-TERT-BUTYL-2-OXAZOLINE)
2,2-isopropylidenebis((4S)-4-tert-butyl-2-oxazol
Isopropylidenebisbutyloxazoline
(S,S)-(-)-2,2-Isopropylidenebis(4-Tert-Butyl-2-Oxazolin
(S,S)-2,2''-ISOPROPYLIDENE-BIS(4-TERT-BUTYL-2-OXAZOLINE) 98+%
[Molecular Formula]

C17H30N2O2
[MDL Number]

MFCD00192243
[Molecular Weight]

294.43
[MOL File]

131833-93-7.mol
Chemical PropertiesBack Directory
[Melting point ]

89-91 °C(lit.)
[Boiling point ]

350.4±25.0 °C(Predicted)
[density ]

1.04±0.1 g/cm3(Predicted)
[refractive index ]

-118 ° (C=1, CHCl3)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

insol H2O; sol all common organic solvents
[form ]

Crystalline Powder
[pka]

5.69±0.70(Predicted)
[color ]

White to light yellow
[Optical Rotation]

[α]20/D 120°, c = 5 in chloroform
[InChI]

InChI=1S/C17H30N2O2/c1-15(2,3)11-9-20-13(18-11)17(7,8)14-19-12(10-21-14)16(4,5)6/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1
[InChIKey]

DPMGLJUMNRDNMX-VXGBXAGGSA-N
[SMILES]

C(C1=N[C@@H](C(C)(C)C)CO1)(C1=N[C@@H](C(C)(C)C)CO1)(C)C
[CAS DataBase Reference]

131833-93-7(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[HS Code ]

29349990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

Chiral catalyst for asymmetric synthesis. C2 symmetric ligand for enantioselective catalysis. Easily forms bidentate coordination complexes due to the strong affinity of the oxazoline nitrogen for various metals.
[Preparation]

(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE) is readily prepared from chiral β-amino alcohols using standard methods for the synthesis of 2-oxazolines.
[storage]

(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE) is stable at ambient temperature; for longer periods, storage at -20 °C is recommended.
Spectrum DetailBack Directory
[Spectrum Detail]

(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE)(131833-93-7)1HNMR
(S,S)-(-)-2,2'-ISOPROPYLIDENEBIS(4-TERT-BUTYL-2-OXAZOLINE)(131833-93-7)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

131833-93-7(sigmaaldrich)
[TCI AMERICA]

(S,S)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline),>95.0%(GC)(131833-93-7)
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