1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester

Base Information

Chemical Name:1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester
CAS No.:907602-77-1
Molecular Formula:C₁₈H₂₂N₂O₃
Molecular Weight:314.384
Hs Code.:2933990090
Mol file:907602-77-1.mol

Synonyms:1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester

Suppliers and Price of 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester

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

Chemenu
tert-butyl3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate 95%
1g
$ 729.00

American Custom Chemicals Corporation
TERT-BUTYL-3-(2-CYANOPROPAN-2-YL)-5-METHOXY-1H-INDOLE-1-CARBOXYLATE 95.00%
5MG
$ 500.41

Total 3 raw suppliers

Chemical Property of 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester

Chemical Property:

Vapor Pressure:1.8E-08mmHg at 25°C
Refractive Index:1.534
Boiling Point:455.1°C at 760 mmHg
Flash Point:229°C
PSA：64.25000
Density:1.08g/cm³
LogP:4.23428
Storage Temp.:2-8°C

Purity/Quality:

95+% ^*data from raw suppliers

tert-butyl3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester

There total 1 articles about 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester 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: 92.6%

: 896101-79-4
3-(cyanomethyl)-5-methoxy-1H-indol-1-carboxylic acid tertbutyl ester

: 74-88-4
methyl iodide

: 907602-77-1
tert-butyl-3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate

Guidance literature:: With sodium hydride; In N,N-dimethyl-formamide; at -5 - 20 ℃; for 4h;

Reference yield: 63.0%

: 907602-77-1
tert-butyl-3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate

: 896101-81-8
2-(5-methoxy-1H-indol-3-yl)-2-methylpropanonitrile

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 5h;
DOI:10.1016/j.bmcl.2007.05.101

Reference yield:

: 907602-77-1
tert-butyl-3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate

: 13608-23-6
6-methoxy-4,4-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Guidance literature:: Multi-step reaction with 5 steps

1: 63 percent / TFA / CH₂Cl₂ / 5 h / 20 °C

2: 68 percent / LAH / tetrahydrofuran / 3 h / 20 °C

3: 78 percent / 3 h / Heating

4: 38 percent / POCl₃ / CHCl₃ / 3 h / Heating

5: 55 percent / NaBH₄ / ethanol / 4 h / 20 °C

With sodium tetrahydroborate; lithium aluminium tetrahydride; trifluoroacetic acid; trichlorophosphate; In tetrahydrofuran; ethanol; dichloromethane; chloroform;
DOI:10.1016/j.bmcl.2007.05.101