3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid

Base Information

Chemical Name:3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid
CAS No.:77903-96-9
Molecular Formula:C11H11 N O3
Molecular Weight:205.213
Hs Code.:2933990090
ChEMBL ID:CHEMBL24757
DSSTox Substance ID:DTXSID00586359
Nikkaji Number:J377.453H
Wikidata:Q82478472
Mol file:77903-96-9.mol

Synonyms:77903-96-9;3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid;3-(2-Hydroxy ethyl)-1H-indole-2-carboxylic acid;3-(2-Hydroxyethyl)-1H-indole-2-carboxylicacid;CHEMBL24757;SCHEMBL5955774;DTXSID00586359;HLPQCBDJFGTCJM-UHFFFAOYSA-N;AKOS005068001;AC-12242;DB-104914

Suppliers and Price of 3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid

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-(2-HYDROXY ETHYL)-1H-INDOLE-2-CARBOXYLIC ACID 95.00%
1G
$ 1030.84

Total 2 raw suppliers

Chemical Property of 3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.71
Boiling Point:478.992°C at 760 mmHg
Flash Point:243.486°C
PSA：73.32000
Density:1.418g/cm³
LogP:1.40090
XLogP3:1.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:205.07389321
Heavy Atom Count:15
Complexity:244

Purity/Quality:

99% ^*data from raw suppliers

3-(2-HYDROXY ETHYL)-1H-INDOLE-2-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCO

Technology Process of 3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid

There total 1 articles about 3-(2-hydroxyethyl)-1H-indole-2-carboxylic acid 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: 90.0%

: 6250-88-0
4,9-Dihydropyrano<3,4-b>indol-1(3H)-on

: 77903-96-9
3-(2-Hydroxyethyl)-1H-indole-2-carboxylic acid

Guidance literature:: With lithium hydroxide; In methanol; for 2h;
DOI:10.1021/jo00329a029

Reference yield:

: 77903-96-9
3-(2-Hydroxyethyl)-1H-indole-2-carboxylic acid

: 77903-75-4
2-<2-(1-Cyanoethyl)-1H-indol-3-yl>ethyl p-toluenesulfonate

Guidance literature:: Multi-step reaction with 8 steps

1: 89 percent / diethyl ether; tetrahydrofuran / 3 h

2: 95 percent / Hydrazine Hydrate, KOH / bis-(2-hydroxy-ethyl) ether / 7 h / 100 - 200 °C

3: 98.5 percent / Imidazole / dimethylformamide / 168 h

4: tert-Butylhypochlorite, Triethylamine / CH₂Cl₂ / 1 h / -78 °C

5: 74 percent / methanol / 120 h

6: 90 percent / ethyl acetate / 4 h / Ambient temperature

7: 91 percent / 18-crown-6 / acetonitrile / 48 h / 60 °C

8: γ-Collidine / benzene / 1 h / 25 °C

With 1H-imidazole; 2,4,6-trimethyl-pyridine; potassium hydroxide; 18-crown-6 ether; tert-butylhypochlorite; hydrazine hydrate; triethylamine; In tetrahydrofuran; methanol; diethyl ether; dichloromethane; ethyl acetate; N,N-dimethyl-formamide; acetonitrile; diethylene glycol; benzene;
DOI:10.1021/jo00329a029

Reference yield:

: 77903-96-9
3-(2-Hydroxyethyl)-1H-indole-2-carboxylic acid

: 77903-83-4
N-<2-<2-(1-Cyanoethyl)-1H-indol-3-yl>ethyl>-3-ethylpyridinium p-toluenesulfonate hemihydrate

Guidance literature:: Multi-step reaction with 9 steps

1: 89 percent / diethyl ether; tetrahydrofuran / 3 h

2: 95 percent / Hydrazine Hydrate, KOH / bis-(2-hydroxy-ethyl) ether / 7 h / 100 - 200 °C

3: 98.5 percent / Imidazole / dimethylformamide / 168 h

4: tert-Butylhypochlorite, Triethylamine / CH₂Cl₂ / 1 h / -78 °C

5: 74 percent / methanol / 120 h

6: 90 percent / ethyl acetate / 4 h / Ambient temperature

7: 91 percent / 18-crown-6 / acetonitrile / 48 h / 60 °C

8: γ-Collidine / benzene / 1 h / 25 °C

9: benzene

With 1H-imidazole; 2,4,6-trimethyl-pyridine; potassium hydroxide; 18-crown-6 ether; tert-butylhypochlorite; hydrazine hydrate; triethylamine; In tetrahydrofuran; methanol; diethyl ether; dichloromethane; ethyl acetate; N,N-dimethyl-formamide; acetonitrile; diethylene glycol; benzene;
DOI:10.1021/jo00329a029