1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde

Base Information

Chemical Name:1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde
CAS No.:113306-16-4
Molecular Formula:C14H11N3O
Molecular Weight:237.261
Hs Code.:
DSSTox Substance ID:DTXSID90552588
Wikidata:Q82432940
Mol file:113306-16-4.mol

Synonyms:113306-16-4;1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde;DTXSID90552588

Suppliers and Price of 1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde

Supply Marketing:

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

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Chemical Property of 1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:237.090211983
Heavy Atom Count:18
Complexity:285

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)N2C(=C(C=N2)C=O)N3C=CC=C3

Technology Process of 1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde

There total 1 articles about 1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbaldehyde 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: 97.0%

: 112633-58-6
4-Hydroxymethyl-1-phenyl-5-(1-pyrryl)pyrazole

: 113306-16-4
4-formyl-1-phenyl-5-(1-pyrryl)pyrazole

Guidance literature:: With pyridinium chlorochromate; In dichloromethane; for 1.5h; Ambient temperature;
DOI:10.1002/jhet.5570240544

Reference yield: 86.0%

: 867-13-0
diethoxyphosphoryl-acetic acid ethyl ester

: 113306-16-4
4-formyl-1-phenyl-5-(1-pyrryl)pyrazole

: 113306-17-5
ethyl trans-3-<1-phenyl-5-(1-pyrryl)pyrazol-4-yl>propenoate

Guidance literature:: With potassium carbonate; In ethanol; at 70 ℃; for 2h;
DOI:10.1002/jhet.5570240544

Reference yield:

: 113306-16-4
4-formyl-1-phenyl-5-(1-pyrryl)pyrazole

: 113306-23-3
5,6-dihydro-1-phenyl-1H,4H-pyrazolo<4,3-f>pyrrolo<1,2-a>azepine

Guidance literature:: Multi-step reaction with 5 steps

1: 86 percent / potassium carbonate / ethanol / 2 h / 70 °C

2: 97 percent / H₂ / 10percent palladium on charcoal / ethyl acetate / 6 h / 45 °C / 2585.7 Torr

3: 98 percent / aq. ethanol; aq. KOH / 1.25 h / Heating

4: 92 percent / polyphosphoric acid / 1 h / 90 °C

5: 88 percent / aluminum chloride, lithium aluminum hydride / diethyl ether; tetrahydrofuran / 0.75 h / Ambient temperature

With lithium aluminium tetrahydride; aluminium trichloride; PPA; hydrogen; potassium carbonate; palladium on activated charcoal; In tetrahydrofuran; potassium hydroxide; diethyl ether; ethanol; ethyl acetate;
DOI:10.1002/jhet.5570240544