3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-

Base Information

Chemical Name:3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-
CAS No.:58532-80-2
Molecular Formula:C22H17N3O3
Molecular Weight:371.395
Hs Code.:
ChEMBL ID:CHEMBL4866857
DSSTox Substance ID:DTXSID60482464

Synonyms:58532-80-2;CHEMBL4866857;3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-;DTXSID60482464;BDBM50571089;4-(2-Nitrobenzyl)-1,3-diphenyl-1H-pyrazol-5(4H)-one

Suppliers and Price of 3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-

Supply Marketing:

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

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Chemical Property of 3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:371.12699141
Heavy Atom Count:28
Complexity:603

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=NN(C(=O)C2CC3=CC=CC=C3[N+](=O)[O-])C4=CC=CC=C4

Technology Process of 3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl-

There total 6 articles about 3H-Pyrazol-3-one, 2,4-dihydro-4-[(2-nitrophenyl)methyl]-2,5-diphenyl- 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:

: 957374-78-6
(+/-)-methyl 2-(2-nitrobenzyl)-3-phenyl-3-oxopropanoate

: 100-63-0
phenylhydrazine

: 58532-80-2
4-(2-nitro-benzyl)-2,5-diphenyl-1,2-dihydro-pyrazol-3-one

Guidance literature:: In neat (no solvent); at 120 ℃; Inert atmosphere;
DOI:10.1002/cmdc.202000850

Reference yield:

: 94-02-0
ethyl 3-oxo-3-phenylpropionate

: 58532-80-2
4-(2-nitro-benzyl)-2,5-diphenyl-1,2-dihydro-pyrazol-3-one

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / acetone / 0.08 h / Reflux; Inert atmosphere

1.2: Inert atmosphere; Reflux

2.1: ethanol / Reflux

With potassium carbonate; In ethanol; acetone;
DOI:10.1039/d1cc01123e

Reference yield:

: 3958-60-9
2-nitrophenylmethyl bromide

: 58532-80-2
4-(2-nitro-benzyl)-2,5-diphenyl-1,2-dihydro-pyrazol-3-one

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / acetone / 0.08 h / Reflux; Inert atmosphere

1.2: Inert atmosphere; Reflux

2.1: ethanol / Reflux

With potassium carbonate; In ethanol; acetone;
DOI:10.1039/d1cc01123e