Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylate

Base Information

Chemical Name:Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylate
CAS No.:184705-03-1
Molecular Formula:C19H19 N O3
Molecular Weight:309.36
Hs Code.:2933990090
DSSTox Substance ID:DTXSID80371624
Nikkaji Number:J806.068A
Wikidata:Q82159015
Mol file:184705-03-1.mol

Synonyms:Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylate;184705-03-1;methyl 1-benzyl-2-ethyl-5-hydroxyindole-3-carboxylate;Maybridge1_006448;Oprea1_128384;SCHEMBL14880137;HMS559N02;DTXSID80371624;CCG-53820;MFCD00816712;FT-0628360;SR-01000642960-1;Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3carboxylate;1-Benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylic acid methyl ester;2-Ethyl-1-benzyl-5-hydroxy-1H-indole-3-carboxylic acid methyl ester

Suppliers and Price of Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-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
METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE 95.00%
5G
$ 1158.23

American Custom Chemicals Corporation
METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE 95.00%
1G
$ 679.37

AHH
Methyl1-benzyl-2-ethyl-5-hydroxy-1H-indole-3carboxylate 98%
25g
$ 512.00

Total 10 raw suppliers

Chemical Property of Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylate

Chemical Property:

Vapor Pressure:8.57E-12mmHg at 25°C
Melting Point:199-200
Refractive Index:1.593
Boiling Point:528.7°Cat760mmHg
PKA:9.28±0.40(Predicted)
Flash Point:273.5°C
PSA：51.46000
Density:1.17g/cm³
LogP:3.74420
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:309.13649347
Heavy Atom Count:23
Complexity:407

Purity/Quality:

98%Min ^*data from raw suppliers

METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:

Useful:

Canonical SMILES:CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)O)C(=O)OC

Technology Process of Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylate

There total 5 articles about Methyl 1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-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: 69.0%

: 184705-06-4
methyl 3-(benzylamino)pent-2-enoate

: 106-51-4
p-benzoquinone

: 184705-03-1
1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylic acid methyl ester

Guidance literature:: In nitromethane; for 48h; Ambient temperature; further solvents;
DOI:10.1021/jo9614452

Reference yield:

: 30414-53-0
methyl propanoyl acetate

: 184705-03-1
1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 95.7 percent / p-toluenesulfonic acid monohydrate / toluene / 3 h / Heating

2: 1.68 g / nitromethane / 48 h / 20 °C

With toluene-4-sulfonic acid; In nitromethane; toluene;
DOI:10.1016/S0968-0896(00)00292-3

Reference yield:

: 100-46-9
benzylamine

: 184705-03-1
1-benzyl-2-ethyl-5-hydroxy-1H-indole-3-carboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: p-TsOH*H₂O / toluene / 4 h / Heating

2: 69 percent / nitromethane / 48 h / Ambient temperature; further solvents

With toluene-4-sulfonic acid; In nitromethane; toluene;
DOI:10.1021/jo9614452