Tisch

Base Information

Chemical Name:Tisch
CAS No.:131567-14-1
Molecular Formula:C17H17 Cl I N O
Molecular Weight:413.68
Hs Code.:
UNII:4KO50R43BQ
DSSTox Substance ID:DTXSID40927267
ChEMBL ID:CHEMBL172352
Mol file:131567-14-1.mol

Synonyms:7-chloro-8-hydroxy-1-(3'-iodophenyl)-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;7-chloro-8-hydroxy-1-(3'-iodophenyl)-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, R(+)-isomer;7-chloro-8-hydroxy-1-(3'-iodophenyl)-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, S(-)-isomer;TISCH

Suppliers and Price of Tisch

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

Total 1 raw suppliers

Chemical Property of Tisch

Chemical Property:

Boiling Point:471.8°Cat760mmHg
Flash Point:239.2°C
PSA：23.47000
Density:1.58g/cm³
LogP:4.20790
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:413.00434
Heavy Atom Count:21
Complexity:356

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=CC(=C(C=C2C(C1)C3=CC(=CC=C3)I)O)Cl

Technology Process of Tisch

There total 2 articles about Tisch 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: 40.0%

: 131615-58-2
(+/-)-7-chloro-8-methoxy-3-methyl-1-(3'-iodophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine

: 131567-14-1
(+/-)-7-chloro-8-hydroxy-1-(3'-iodophenyl)-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Guidance literature:: With boron tribromide; In dichloromethane; for 2h; Ambient temperature;
DOI:10.1021/jm00107a002

Reference yield:

: 131567-13-0
7-Chloro-8-methoxy-3-methyl-1-(3-tributylstannanyl-phenyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine

: 131567-14-1
(+/-)-7-chloro-8-hydroxy-1-(3'-iodophenyl)-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Guidance literature:: Multi-step reaction with 2 steps

1: 75 percent / I₂ / CHCl₃ / Ambient temperature

2: 40 percent / BBr₃ / CH₂Cl₂ / 2 h / Ambient temperature

With iodine; boron tribromide; In dichloromethane; chloroform;
DOI:10.1021/jm00107a002