5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone

Base Information

Chemical Name:5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone
CAS No.:93040-67-6
Molecular Formula:C12H12F3NO2
Molecular Weight:259.2244
Hs Code.:
DSSTox Substance ID:DTXSID90918761
ChEMBL ID:CHEMBL320378

Synonyms:BRN 6515051;93040-67-6;5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone;2-Pyrrolidinone, 5-hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-;5-hydroxy-1-methyl-5-[4-(trifluoromethyl)phenyl]pyrrolidin-2-one;CHEMBL320378;DTXSID90918761;LS-138859

Suppliers and Price of 5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone

Supply Marketing:

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

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Chemical Property of 5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone

Chemical Property:

Vapor Pressure:1.22E-06mmHg at 25°C
Boiling Point:385.7°Cat760mmHg
Flash Point:187.1°C
Density:1.368g/cm³
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:259.08201311
Heavy Atom Count:18
Complexity:337

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=O)CCC1(C2=CC=C(C=C2)C(F)(F)F)O

Technology Process of 5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)-2-pyrrolidinone

There total 1 articles about 5-Hydroxy-1-methyl-5-(4-(trifluoromethyl)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:

: 1121-07-9
N-methylsuccinimide

: 402-43-7
p-trifluoromethylphenyl bromide

: 93040-67-6
5-hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)pyrrolidin-2-one

Guidance literature:: With magnesium; Yield given. Multistep reaction; 1.) Et₂O, reflux, 1 h, 2.) Et₂O, C₆H₆, reflux, 4 h;
DOI:10.1021/jm00379a007

Reference yield:

: 93040-67-6
5-hydroxy-1-methyl-5-(4-(trifluoromethyl)phenyl)pyrrolidin-2-one

: (R)-1-methyl-5-(4-(trifluoromethyl)phenyl)pyrrolidin-2-one

: 1-methyl-5-(4-(trifluoromethyl)phenyl)pyrrolidin-2-one

Guidance literature:: With bis(1,5-cyclooctadiene)diiridium(I) dichloride; hydrogen; iodine; (3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)-bis-((R)-1-phenyl-ethyl)-amine; In 2,2,2-trifluoroethanol; at 20 ℃; for 24h; under 37503.8 Torr; Overall yield = 97 %; Overall yield = 47.3 mg; enantioselective reaction; Autoclave; Inert atmosphere;
DOI:10.1021/acs.orglett.7b00651