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3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Base Information
  • Chemical Name:3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine
  • CAS No.:135974-57-1
  • Molecular Formula:C19H20 Br N O2 . Br H
  • Molecular Weight:455.189
  • Hs Code.:
  • Nikkaji Number:J442.694K
  • Wikipedia:6-Br-APB
  • ChEMBL ID:CHEMBL32145
  • Mol file:135974-57-1.mol
3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Synonyms:3-allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine;6-Br-APB

Suppliers and Price of 3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine
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 18 raw suppliers
Chemical Property of 3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine
Chemical Property:
  • Vapor Pressure:1.16E-09mmHg at 25°C 
  • Boiling Point:475.4°Cat760mmHg 
  • Flash Point:241.3°C 
  • PSA:43.70000 
  • Density:1.378g/cm3 
  • LogP:3.97420 
  • XLogP3:4.3
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:3
  • Exact Mass:373.06774
  • Heavy Atom Count:23
  • Complexity:399
Purity/Quality:

99% *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C=CCN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)O)O)Br
Technology Process of 3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine

There total 4 articles about 3-Allyl-6-bromo-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine 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:
Guidance literature:
With boron tribromide; In hexane; dichloromethane; 1.) -70 deg C, 1 h, 2.) RT, 24 h;
DOI:10.1021/jm00116a004
Guidance literature:
Multi-step reaction with 4 steps
1: 95 percent / trifluoroacetic acid, H2SO4 / 3 h / Heating
2: 69 percent / glacial acetic acid, bromine / 2 h / Ambient temperature
3: 60 percent / K2CO3 / dimethylformamide / Ambient temperature
4: 66 percent / boron tribromide / CH2Cl2; hexane / 1.) -70 deg C, 1 h, 2.) RT, 24 h
With sulfuric acid; bromine; boron tribromide; potassium carbonate; acetic acid; trifluoroacetic acid; In hexane; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00116a004
Guidance literature:
Multi-step reaction with 3 steps
1: 69 percent / glacial acetic acid, bromine / 2 h / Ambient temperature
2: 60 percent / K2CO3 / dimethylformamide / Ambient temperature
3: 66 percent / boron tribromide / CH2Cl2; hexane / 1.) -70 deg C, 1 h, 2.) RT, 24 h
With bromine; boron tribromide; potassium carbonate; acetic acid; In hexane; dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm00116a004
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