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(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide

Catalog Number
ACM910110451
Product Name
(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide
Structure
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CAS
910110-45-1
  • Product Overview
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Synonyms
910110-45-1;(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide;Singh's Catalyst;N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-L-prolinamide;MFCD22200506;ZINC86012820;N-[(S)-1-(alpha-Hydroxybenzhydryl)-3-methylbutyl]-L-prolinamide;(S)-N-[(S)-1-Hydroxy-4-methyl-1,1-diphenylpentan-2-yl]pyrrolidine-2-carboxamide;(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide, >=98.0% (HPLC);
IUPAC Name
(2S)-N-[(2S)-1-hydroxy-4-methyl-1,1-diphenylpentan-2-yl]pyrrolidine-2-carboxamide;
Molecular Weight
366.505g/mol
Molecular Formula
C23H30N2O2;
Canonical SMILES
CC(C)CC(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)NC(=O)C3CCCN3;
InChI
InChI=1S/C23H30N2O2/c1-17(2)16-21(25-22(26)20-14-9-15-24-20)23(27,18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-8,10-13,17,20-21,24,27H,9,14-16H2,1-2H3,(H,25,26)/t20-,21-/m0/s1;
InChI Key
PWBULUUPVDXEQS-SFTDATJTSA-N;
Complexity
449
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
366.231g/mol
H-Bond Acceptor
3
H-Bond Donor
3
Heavy Atom Count
27
Monoisotopic Mass
366.231g/mol
Rotatable Bond Count
7
Topological Polar Surface Area
61.4A^2
Application
(2S)-N-[(1S)-1-(Hydroxydiphenylmethyl)-3-methylbutyl]-2-pyrrolidinecarboxamide serves as a catalyst specifically designed for facilitating Aldol reactions. Its primary purpose is to enhance the efficiency and selectivity of these reactions, thus aiding in the synthesis of complex molecules by promoting the formation of carbon-carbon bonds in organic chemistry.
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