(4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone

Base Information

Chemical Name:(4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone
CAS No.:114376-79-3
Molecular Formula:C₁₂H₁₅NO₂
Molecular Weight:205.257
Hs Code.:
DSSTox Substance ID:DTXSID701187832

Synonyms:SCHEMBL8744078;DTXSID701187832;(4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone;114376-79-3

Suppliers and Price of (4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of (4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone

Chemical Property:

XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:205.110278721
Heavy Atom Count:15
Complexity:236

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1C(C(CC1=O)C2=CC=CC=C2)CO
Isomeric SMILES:CN1[C@@H]([C@@H](CC1=O)C2=CC=CC=C2)CO

Technology Process of (4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone

There total 14 articles about (4S,5S)-5-(Hydroxymethyl)-1-methyl-4-phenyl-2-pyrrolidinone which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

: C₁₇H₂₇NO₃Si

: 114376-79-3
(4S,5S)-5-hydroxymethyl-1-methyl-4-phenylpyrrolidin-2-one

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; enantioselective reaction;
DOI:10.1055/s-0031-1290804

Reference yield: 89.2%

: 109838-79-1,109838-80-4
(+/-)-(4R^*,5R^*)-5-(ethoxycarbonyl)-1-methyl-4-phenylpyrrolidin-2-one

: 109838-81-5,110171-70-5,114376-79-3
(+/-)-(4R^*,5R^*)-5-(hydroxymethyl)-1-methyl-4-phenylpyrrolidin-2-one

Guidance literature:: With lithium triethylborohydride; In tetrahydrofuran; at 0 ℃; for 1h;
DOI:10.1021/jo00228a037

Reference yield:

: 406687-92-1
5-ethoxycarbonyl-1-methyl-4-phenyl-3-pyrrolin-2-one

: 109838-81-5,110171-70-5,114376-79-3
(+/-)-(4R^*,5R^*)-5-(hydroxymethyl)-1-methyl-4-phenylpyrrolidin-2-one

Guidance literature:: Multi-step reaction with 2 steps

1: H₂ / Pd/C

2: 83 percent / lithium triethylborohydride / tetrahydrofuran / 1 h / 0 °C

With hydrogen; lithium triethylborohydride; palladium on activated charcoal; In tetrahydrofuran;
DOI:10.1016/j.bmcl.2006.06.041