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323196-43-6

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323196-43-6 Usage

Uses

Used in first highly enantioselective organocatalytic Diels-Alder reaction and 1,3-dipolar addition.

Check Digit Verification of cas no

The CAS Registry Mumber 323196-43-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,2,3,1,9 and 6 respectively; the second part has 2 digits, 4 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 323196-43:
(8*3)+(7*2)+(6*3)+(5*1)+(4*9)+(3*6)+(2*4)+(1*3)=126
126 % 10 = 6
So 323196-43-6 is a valid CAS Registry Number.
InChI:InChI=1/C13H18N2O.ClH/c1-13(2)14-11(12(16)15(13)3)9-10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/t11-;/m1./s1

323196-43-6 Well-known Company Product Price

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  • Aldrich

  • (663069)  (5R)-(+)-2,2,3-Trimethyl-5-benzyl-4-imidazolidinonemonohydrochloride  97%

  • 323196-43-6

  • 663069-500MG

  • 563.94CNY

  • Detail
  • Aldrich

  • (663069)  (5R)-(+)-2,2,3-Trimethyl-5-benzyl-4-imidazolidinonemonohydrochloride  97%

  • 323196-43-6

  • 663069-2G

  • 1,674.27CNY

  • Detail

323196-43-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name (5R)-2,2,3-TRIMETHYL-5-PHENYLMETHYL-4-IMIDAZOLIDINONE MONOHYDROCHLORIDE

1.2 Other means of identification

Product number -
Other names MacMillan catalyst

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:323196-43-6 SDS

323196-43-6Downstream Products

323196-43-6Relevant articles and documents

Structural diversity in imidazolidinone organocatalysts: A synchrotron and computational study

Burley, Jonathan C.,Gilmour, Ryan,Prior, Timothy J.,Day, Graeme M.

, p. o10-o14 (2008/09/18)

(5)-1-(Methylaminocarbonyl)-3-phenylpropanaminium chloride (52·HCl), C10H15N2O+·Cl-, crystallizes in the orthorhombic space group P21212 1 with a single formula unit per asymmetric unit. (5R/S)-5-Benzyl-2,2,3-trimethyl-4-oxoimidazolidin-1-ium chloride (R3 and S3), C13H19N2O+·Cl-, crystallize in the same space group as S2-HCl but contain three symmetry-independent formula units. (R/S)-5-Benzyl-2,2,3-trimethyl-4- oxoimidazolidin-1-ium chloride monohydrate (R4 and S4), C13H 19N2O+-Cl-·H2O, crystallize in the space group P21 with a single formula unit per asymmetric unit. Calculations at the B3LYP/6-31G(d,p) and B3LYP/6-311G(d,p) levels of the conformational energies of the cation in R3, S3, R4 and S4 indicate that the ideal gas-phase global energy minimum conformation is not observed in the solid state. Rather, the effects of hydrogen-bonding and van der Waals interactions in the crystal structure cause the molecules to adopt higher-energy conformations, which correspond to local minima in the molecular potential energy surface.

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