1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole

Base Information

Chemical Name:1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole
CAS No.:153432-73-6
Molecular Formula:C₂₁H₂₇NOSi
Molecular Weight:337.537
Hs Code.:
DSSTox Substance ID:DTXSID30438014
Nikkaji Number:J618.118J
Wikidata:Q82253620
Mol file:153432-73-6.mol

Synonyms:153432-73-6;1-(TERT-BUTOXYCARBONYL)-2-(4-CYANOPHENYL)INDOLE;Tert-butyl 2-(4-cyanophenyl)indole-1-carboxylate;tert-Butyl 2-(4-cyanophenyl)-1H-indole-1-carboxylate;SCHEMBL17220678;DTXSID30438014;AKOS015964884;1-(tert-Butoxycarbonyl)-2-(4-cyanophenyl)-1H-indole;tert-Butyl2-(4-cyanophenyl)-1H-indole-1-carboxylate

Suppliers and Price of 1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole

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

American Custom Chemicals Corporation
1-(TERT-BUTOXYCARBONYL)-2-(4-CYANOPHENYL)INDOLE 95.00%
5MG
$ 500.06

Total 2 raw suppliers

Chemical Property of 1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole

Chemical Property:

Boiling Point:446.0±35.0 °C(Predicted)
PSA：55.02000
Density:0.99±0.1 g/cm3(Predicted)
LogP:4.96318
XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:318.136827821
Heavy Atom Count:24
Complexity:508

Purity/Quality:: 1-(TERT-BUTOXYCARBONYL)-2-(4-CYANOPHENYL)INDOLE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1C2=CC=CC=C2C=C1C3=CC=C(C=C3)C#N

Technology Process of 1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole

There total 5 articles about 1-(Tert-butoxycarbonyl)-2-(4-cyanophenyl)indole 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: 93.0%

: 615-37-2
ortho-methylphenyl iodide

: 153432-70-3
2-(tributylstannyl)-1-<<2-(trimethylsilyl)ethoxy>methyl>-1H-indole

: 153432-73-6
2-(2'-methylphenyl)-1-<<2-(trimethylsilyl)ethoxy>methyl>-1H-indole

Guidance literature:: ; In N,N-dimethyl-formamide; at 110 ℃; for 2h;
DOI:10.1002/hlca.19930760622

Reference yield: 89.0%

: 2-(hydroxydimethylsilyl)-1-[[2-(trimethylsilyl)ethoxy]methyl]-1H-indole sodium salt

: 95-46-5
2-methylphenyl bromide

: 153432-73-6
2-(2'-methylphenyl)-1-<<2-(trimethylsilyl)ethoxy>methyl>-1H-indole

Guidance literature:: tri(tert-butyl)phosphine palladium complex; In toluene; at 50 ℃; for 8h;
DOI:10.1021/jo7023784

Reference yield:

: 615-37-2
ortho-methylphenyl iodide

: 87954-27-6
1-[[2-(trimethylsilyl)ethoxy]methyl]-1H-indole

: 3-(o-tolyl)-1-[(2-(trimethylsilyl)ethoxy)methyl]indole

: 153432-73-6
2-(2'-methylphenyl)-1-<<2-(trimethylsilyl)ethoxy>methyl>-1H-indole

Guidance literature:: With palladium(II) complex with imidazolyl carbene ligand; cesium acetate; In N,N-dimethyl acetamide; at 125 ℃; for 24h;
DOI:10.1021/ol053021c