(2-Phenylindol-1-yl) 4-nitrobenzoate

Base Information

Chemical Name:(2-Phenylindol-1-yl) 4-nitrobenzoate
CAS No.:37914-49-1
Molecular Formula:C₂₁H₁₄N₂O₄
Molecular Weight:358.353
Hs Code.:
NSC Number:176897
DSSTox Substance ID:DTXSID80306476
Wikidata:Q82053604
Mol file:37914-49-1.mol

Synonyms:37914-49-1;(2-phenylindol-1-yl) 4-nitrobenzoate;NSC176897;DTXSID80306476;NSC-176897

Suppliers and Price of (2-Phenylindol-1-yl) 4-nitrobenzoate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of (2-Phenylindol-1-yl) 4-nitrobenzoate

Chemical Property:

Vapor Pressure:9.65E-14mmHg at 25°C
Boiling Point:586.6°Cat760mmHg
Flash Point:308.6°C
Density:1.29g/cm³
XLogP3:5.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:358.09535693
Heavy Atom Count:27
Complexity:535

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Technology Process of (2-Phenylindol-1-yl) 4-nitrobenzoate

There total 5 articles about (2-Phenylindol-1-yl) 4-nitrobenzoate 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:

: 1859-39-8
2-phenyl-N-hydroxyindole

: 122-04-3
4-nitro-benzoyl chloride

: 37914-49-1
2-phenyl-1H-indol-1-yl 4-nitrobenzoate

Guidance literature:: With triethylamine; In dichloromethane; at 23 ℃;
DOI:10.1021/acs.orglett.2c00085

Reference yield:

: 35010-17-4
1-nitro-2-phenylethynyl-benzene

: 37914-49-1
2-phenyl-1H-indol-1-yl 4-nitrobenzoate

Guidance literature:: Multi-step reaction with 3 steps

1: hydrazine hydrate monohydrate; nickel; ethanol / 1,2-dichloro-ethane / 12 h / 23 °C

2: palladium (II) chloride / acetonitrile / 12 h / 35 - 40 °C

3: triethylamine / dichloromethane / 23 °C

With ethanol; nickel; hydrazine hydrate monohydrate; triethylamine; palladium (II) chloride; In dichloromethane; 1,2-dichloro-ethane; acetonitrile;
DOI:10.1021/acs.orglett.2c00085

Reference yield:

: 536-74-3
phenylacetylene

: 37914-49-1
2-phenyl-1H-indol-1-yl 4-nitrobenzoate

Guidance literature:: Multi-step reaction with 4 steps

1.1: [1,1'-bis(diphenylphosphino)ferrocene]dichloropalladium(II); copper (I) iodide; triethylamine / N,N-dimethyl-formamide / 0.5 h / 23 °C / Inert atmosphere

1.2: 24 h / 23 °C / Inert atmosphere

2.1: hydrazine hydrate monohydrate; nickel; ethanol / 1,2-dichloro-ethane / 12 h / 23 °C

3.1: palladium (II) chloride / acetonitrile / 12 h / 35 - 40 °C

4.1: triethylamine / dichloromethane / 23 °C

With [1,1'-bis(diphenylphosphino)ferrocene]dichloropalladium(II); copper (I) iodide; ethanol; nickel; hydrazine hydrate monohydrate; triethylamine; palladium (II) chloride; In dichloromethane; 1,2-dichloro-ethane; N,N-dimethyl-formamide; acetonitrile; 1.1: |Sonogashira Cross-Coupling / 1.2: |Sonogashira Cross-Coupling;
DOI:10.1021/acs.orglett.2c00085