(7-Chloro-2-methyl-1H-indol-3-yl)-acetic acid

Base Information

Chemical Name:(7-Chloro-2-methyl-1H-indol-3-yl)-acetic acid
CAS No.:25177-74-6
Molecular Formula:C₁₁H₁₀ClNO₂
Molecular Weight:223.659
Hs Code.:2933990090
DSSTox Substance ID:DTXSID40398175
Wikidata:Q82200018
Mol file:25177-74-6.mol

Synonyms:25177-74-6;(7-Chloro-2-methyl-1H-indol-3-yl)-acetic acid;2-(7-chloro-2-methyl-1H-indol-3-yl)acetic Acid;(7-chloro-2-methyl-1H-indol-3-yl)acetic acid;DTXSID40398175;AKOS005208314;BB 0248914;EN300-236265;2-(7-chloro-2-methyl-1H-indol-3-yl)aceticAcid;F2113-0487

Suppliers and Price of (7-Chloro-2-methyl-1H-indol-3-yl)-acetic 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

TRC
(7-Chloro-2-methyl-1H-indol-3-yl)-aceticAcid
10mg
$ 45.00

American Custom Chemicals Corporation
(7-CHLORO-2-METHYL-1H-INDOL-3-YL)-ACETIC ACID 95.00%
5MG
$ 499.24

Total 2 raw suppliers

Chemical Property of (7-Chloro-2-methyl-1H-indol-3-yl)-acetic acid

Chemical Property:

Melting Point:164-164.5 °C
Boiling Point:448.4±40.0 °C(Predicted)
PKA:4.07±0.30(Predicted)
PSA：53.09000
Density:1.419±0.06 g/cm3(Predicted)
LogP:2.75680
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:223.0400063
Heavy Atom Count:15
Complexity:259

Purity/Quality:

99% ^*data from raw suppliers

(7-Chloro-2-methyl-1H-indol-3-yl)-aceticAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=C(N1)C(=CC=C2)Cl)CC(=O)O

Technology Process of (7-Chloro-2-methyl-1H-indol-3-yl)-acetic acid

There total 2 articles about (7-Chloro-2-methyl-1H-indol-3-yl)-acetic 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:

: 4-(2-chloro-phenylhydrazono)-valeric acid ethyl ester

: 25177-74-6
(7-chloro-2-methyl-indol-3-yl)-acetic acid

Guidance literature:: With zinc(II) chloride; at 100 ℃; Erwaermen des Reaktionsprodukts mit methanol. KOH;
DOI:10.1021/ja01186a080

Reference yield:

: 539-88-8
4-oxopentanoic acid ethyl ester

: 25177-74-6
(7-chloro-2-methyl-indol-3-yl)-acetic acid

Guidance literature:: Multi-step reaction with 2 steps

2: ZnCl₂ / 100 °C / Erwaermen des Reaktionsprodukts mit methanol. KOH

With zinc(II) chloride;
DOI:10.1021/ja01186a080

Reference yield:

: 25177-74-6
(7-chloro-2-methyl-indol-3-yl)-acetic acid

: 2-(7-chloro-1,2-dimethyl-1H-indol-3-yl)-N-(2,4-dinitrophenoxy)-N-methylacetamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydride / tetrahydrofuran / 0.5 h / 0 °C

1.2: 16 h / 20 °C

2.1: sodium hydride / tetrahydrofuran / 1 h / 0 °C

2.2: 10 h / 20 °C

With sodium hydride; In tetrahydrofuran;
DOI:10.1039/c8cc03575j