78914-69-9 Usage
General Description
(S)-1-Benzyl-beta-prolinol, also known as BnPro, is a chiral organic compound with the molecular formula C13H17NO. It is a white to off-white solid that is soluble in organic solvents and has a melting point of around 72-75°C. This chemical is commonly used as a ligand in asymmetric catalysis and as a chiral auxiliary in organic synthesis. It is also used in the preparation of various pharmaceutical compounds and complex organic molecules. Additionally, (S)-1-benzyl-beta-prolinol has been studied for its potential use in the treatment of certain diseases and as a building block for the synthesis of biologically active compounds. The compound has garnered interest in the field of medicinal chemistry due to its unique structural and chiral properties.
Check Digit Verification of cas no
The CAS Registry Mumber 78914-69-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,8,9,1 and 4 respectively; the second part has 2 digits, 6 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 78914-69:
(7*7)+(6*8)+(5*9)+(4*1)+(3*4)+(2*6)+(1*9)=179
179 % 10 = 9
So 78914-69-9 is a valid CAS Registry Number.
InChI:InChI=1/C12H17NO/c14-10-12-6-7-13(9-12)8-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2/t12-/m0/s1
78914-69-9Relevant articles and documents
A chemoenzymatic approach to the synthesis of enantiomerically pure aza analogues of paraconic acid methyl ester and both enantiomers of methyl β-proline
Felluga, Fulvia,Pitacco, Giuliana,Prodan, Massimo,Pricl, Sabrina,Visintin, Marco,Valentin, Ennio
, p. 3241 - 3249 (2007/10/03)
Enantiopure methyl esters of 1-alkyl-5-oxo-3-pyrrolidinecarboxylic acids were obtained by enzymatic resolution of the corresponding chiral racemic mixtures. A particularly favourable interaction, also supported by molecular mechanics calculations, was observed between the 1-benzyl derivative and α-chymotrypsin, for which the enantiomeric ratio, E, exceeded 200. The absolute configurations of the lactams were determined by means of CD spectroscopy. From the resulting enantiomerically pure (99% e.e.) (S)-(+)-1-benzyl-3-pyrrolidinecarboxylic acid and methyl (R)-(-)-1-benzyl-3-pyrrolidinecarboxylate, the methyl esters of (+) and (-)-β-proline were synthesised in 99% e.e. and 18 and 22% overall yield, respectively.
