methyl 1-(4-chlorobenzyl)-1H-indole-3-carboxylate

Base Information

Chemical Name:methyl 1-(4-chlorobenzyl)-1H-indole-3-carboxylate
CAS No.:761402-59-9
Molecular Formula:C17H14ClNO2
Molecular Weight:299.75200
Hs Code.:2933990090
DSSTox Substance ID:DTXSID20359204
Wikidata:Q82140288
ChEMBL ID:CHEMBL1775163
Mol file:761402-59-9.mol

Synonyms:761402-59-9;methyl 1-(4-chlorobenzyl)-1H-indole-3-carboxylate;methyl 1-[(4-chlorophenyl)methyl]-1H-indole-3-carboxylate;9T-1501;methyl 1-[(4-chlorophenyl)methyl]indole-3-carboxylate;CHEMBL1775163;SCHEMBL24273311;DTXSID20359204;AKOS005106598;1h-indole-3-carboxylic acid,1-[(4-chlorophenyl)methyl]-,methyl ester

Suppliers and Price of methyl 1-(4-chlorobenzyl)-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

Labseeker
1H-INDOLE-3-CARBOXYLICACID,1-[(4-CHLOROPHENYL)METHYL]-,METHYLESTER 95
25g
$ 3675.00

American Custom Chemicals Corporation
1H-INDOLE-3-CARBOXYLIC ACID, 1-[(4-CHLOROPHENYL)METHYL]-,METHYL ESTER 95.00%
5MG
$ 623.82

American Custom Chemicals Corporation
1H-INDOLE-3-CARBOXYLIC ACID, 1-[(4-CHLOROPHENYL)METHYL]-,METHYL ESTER 95.00%
10MG
$ 618.50

American Custom Chemicals Corporation
1H-INDOLE-3-CARBOXYLIC ACID, 1-[(4-CHLOROPHENYL)METHYL]-,METHYL ESTER 95.00%
1MG
$ 586.97

Total 2 raw suppliers

Chemical Property of methyl 1-(4-chlorobenzyl)-1H-indole-3-carboxylate

Chemical Property:

PSA：31.23000
LogP:4.12960
XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:299.0713064
Heavy Atom Count:21
Complexity:368

Purity/Quality:

98% ^*data from raw suppliers

1H-INDOLE-3-CARBOXYLICACID,1-[(4-CHLOROPHENYL)METHYL]-,METHYLESTER 95 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Cl

Technology Process of methyl 1-(4-chlorobenzyl)-1H-indole-3-carboxylate

There total 1 articles about methyl 1-(4-chlorobenzyl)-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:

: 942-24-5
3-methoxycarbonylindole

: 104-83-6
1-Chloro-4-(chloromethyl)benzene

: 761402-59-9
methyl [1-[(4-chlorophenyl)methyl]]-1H-indole-3-carboxylate

Guidance literature:: 3-methoxycarbonylindole; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 0 - 20 ℃;

1-Chloro-4-(chloromethyl)benzene; In N,N-dimethyl-formamide; mineral oil; at 20 ℃;
DOI:10.1039/c5ra15191k

Reference yield:

: 761402-59-9
methyl [1-[(4-chlorophenyl)methyl]]-1H-indole-3-carboxylate

: 93548-89-1
1-[(4-chlorophenyl)methyl]-1H-indole-3-carboxylic acid

Guidance literature:: With sodium hydroxide; In tetrahydrofuran; water; at 20 ℃;
DOI:10.1039/c5ra15191k

Reference yield:

: 761402-59-9
methyl [1-[(4-chlorophenyl)methyl]]-1H-indole-3-carboxylate

: 5-(1-(4-chlorobenzyl)-1H-indol-3-yl)-3-(4-(trifluoromethoxy)phenyl)-1,2,4-oxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydroxide / water; tetrahydrofuran / 20 °C

2: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 2 h / 140 °C

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; sodium hydroxide; In tetrahydrofuran; water; N,N-dimethyl-formamide;
DOI:10.1039/c5ra15191k