tert-Butyl 3-amino-1H-indole-2-carboxylate

Base Information

Chemical Name:tert-Butyl 3-amino-1H-indole-2-carboxylate
CAS No.:165107-89-1
Molecular Formula:C₁₃H₁₆N₂O₂
Molecular Weight:232.282
Hs Code.:
DSSTox Substance ID:DTXSID90598345
Nikkaji Number:J3.449.477K
Wikidata:Q82494096
Mol file:165107-89-1.mol

Synonyms:165107-89-1;tert-Butyl 3-amino-1H-indole-2-carboxylate;3-AMINO-1H-INDOLE-2-CARBOXYLIC ACID TERT-BUTYL ESTER;SCHEMBL5488153;DTXSID90598345;YEBHBHGDSDASKQ-UHFFFAOYSA-N;AMY27358;tert-Butyl3-amino-1H-indole-2-carboxylate;EN300-6510685;3-Amino-1H-indole-2-carboxylic Acid, Tert-butyl Ester

Suppliers and Price of tert-Butyl 3-amino-1H-indole-2-carboxylate

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
3-AMINO-1H-INDOLE-2-CARBOXYLIC ACID-TERT-BUTYL ESTER 95.00%
5MG
$ 496.05

Abosyn
3-Amino-5-nitro-1H-indole-2-carboxylicacidtert-butylester >95%
1g
$ 690.00

Abosyn
3-Amino-1H-indole-2-carboxylicacidtert-butylester >95%
1g
$ 690.00

Total 3 raw suppliers

Chemical Property of tert-Butyl 3-amino-1H-indole-2-carboxylate

Chemical Property:

Boiling Point:403.7±25.0 °C(Predicted)
PKA:15.68±0.30(Predicted)
Density:1.212±0.06 g/cm3(Predicted)
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:232.121177757
Heavy Atom Count:17
Complexity:298

Purity/Quality:

97% ^*data from raw suppliers

3-AMINO-1H-INDOLE-2-CARBOXYLIC ACID-TERT-BUTYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)C1=C(C2=CC=CC=C2N1)N

Technology Process of tert-Butyl 3-amino-1H-indole-2-carboxylate

There total 3 articles about tert-Butyl 3-amino-1H-indole-2-carboxylate 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:

: tert-butyl 2-[(2-cyanophenyl)amino]acetate

: 165107-89-1
t-butyl 3-aminoindole-2-carboxylate

Guidance literature:: With potassium tert-butylate; In tetrahydrofuran; at 20 ℃; for 2h; Cooling with ice; Inert atmosphere;
DOI:10.1016/j.bioorg.2020.103665

Reference yield:

: 1885-29-6
anthranilic acid nitrile

: 165107-89-1
t-butyl 3-aminoindole-2-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydrogencarbonate / tert-butyl alcohol / 48 h / Reflux; Inert atmosphere

2: potassium tert-butylate / tetrahydrofuran / 2 h / 20 °C / Cooling with ice; Inert atmosphere

With potassium tert-butylate; sodium hydrogencarbonate; In tetrahydrofuran; tert-butyl alcohol;
DOI:10.1016/j.bioorg.2020.103665

Reference yield:

: 5292-43-3
bromoacetic acid tert-butyl ester

: 165107-89-1
t-butyl 3-aminoindole-2-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydrogencarbonate / tert-butyl alcohol / 48 h / Reflux; Inert atmosphere

2: potassium tert-butylate / tetrahydrofuran / 2 h / 20 °C / Cooling with ice; Inert atmosphere

With potassium tert-butylate; sodium hydrogencarbonate; In tetrahydrofuran; tert-butyl alcohol;
DOI:10.1016/j.bioorg.2020.103665