5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole

Base Information

Chemical Name:5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole
CAS No.:13673-04-6
Molecular Formula:C11H13NO
Molecular Weight:175.23
Hs Code.:
DSSTox Substance ID:DTXSID10529393
Nikkaji Number:J734.388D
Mol file:13673-04-6.mol

Synonyms:13673-04-6;DTXSID10529393;5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole

Suppliers and Price of 5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole

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

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Chemical Property of 5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole

Chemical Property:

XLogP3:0.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:175.099714038
Heavy Atom Count:13
Complexity:216

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=[N+](CC(C1)C2=CC=CC=C2)[O-]

Technology Process of 5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole

There total 4 articles about 5-Methyl-1-oxo-3-phenyl-3,4-dihydro-2H-1lambda~5~-pyrrole 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: 90.0%

: 122348-55-4,122348-59-8,142232-08-4,1574-86-3
5-nitro-4-phenylpentan-2-one

: 13673-04-6
5-methyl-3-phenyl-3,4-dihydro-2H-pyrrol-1-oxide

: 4-Oxo-2-phenyl-pentanal oxime

Guidance literature:: In ethanol; 0.5M NH₃, 0.5M NH₄Cl buffer; E_T=-1.15 V ECS;

Reference yield: 60.0%

: 122348-55-4,122348-59-8,142232-08-4,1574-86-3
5-nitro-4-phenylpentan-2-one

: 13673-04-6
5-methyl-3-phenyl-3,4-dihydro-2H-pyrrol-1-oxide

Guidance literature:: With ammonium chloride; zinc; In ethanol; at 10 - 15 ℃; for 5h;
DOI:10.1002/(SICI)1097-458X(199605)34:5<351::AID-OMR882>3.0.CO;2-H

Reference yield:

: 1896-62-4
(E)-benzalacetone

: 13673-04-6
5-methyl-3-phenyl-3,4-dihydro-2H-pyrrol-1-oxide

Guidance literature:: Multi-step reaction with 2 steps

1: K₂CO₃; Bu₄NHSO₄ / benzene / 48 h / 50 °C

2: 2.03 g / aq. NH₄Cl; Zn / dioxane / 2 h / 0 °C

With tetra(n-butyl)ammonium hydrogensulfate; potassium carbonate; ammonium chloride; zinc; In 1,4-dioxane; benzene; 1: Michael addition;