SKF 38393 hydrobromide

Base Information

• Chemical Name: SKF 38393 hydrobromide
• CAS No.: 20012-10-6
• Molecular Formula: C16H17NO2.BrH
• Molecular Weight: 336.228
• ChEMBL ID: CHEMBL505308
• Mol file: 20012-10-6.mol

Synonyms:SKF 38393 hydrobromide;20012-10-6;SKF 38393 (hydrobromide);CHEMBL505308;SKF 38393 hydrobromide - Bio-X;1-phenyl-2,3,4,5-tetrahydro-(1H)-3-benzazepine-7,8-diolhydrobromide;5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;hydrobromide;(+/-)-1-Phenyl-2,3,4,5-tetrahydro-(1H)-3-benzazepine-7,8-diol hydrobromide;SR-01000075378;INNWVRBZMBCEJI-UHFFFAOYSA-N;skf38393 hbr;C16H17NO2.HBr;SKF-38393 (hydrobromide);SKF-38393 HBr;SCHEMBL1874365;BCP30804;EX-A3564;HB1840;AKOS024458697;SKF 38393?;HY-12237;CS-0010414;FT-0753972;SR-01000075378-3;1H-3-Benzazepine-7,8-diol,2,3,4,5-tetrahydro-1-phenyl-;SKF-38393 hydrobromide;SKF38393 hydrobromide;SKF38393 HBr;5-phenyl-2, 3, 4, 5-tetrahydro-1H-3-benzazepine-7, 8-diol;7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide

Chemical Property of SKF 38393 hydrobromide

Chemical Property:

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 335.05209
• Heavy Atom Count: 20
• Complexity: 291

Purity/Quality:

98% min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCC(C2=CC(=C(C=C21)O)O)C3=CC=CC=C3.Br

Technology Process of SKF 38393 hydrobromide

There total 4 articles about SKF 38393 hydrobromide 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: 90.0%

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenyl-2-hydroxyethylamine (20011-97-6) → 7,8-Dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine Hydrobromide (20012-10-6)

Guidance literature:

With hydrogen bromide; for 3h; Heating;

DOI:10.1021/jm00384a006

Reference yield:

styrene oxide (96-09-3) → 7,8-Dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine Hydrobromide (20012-10-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 42 percent / 16 h / 90 - 100 °C

2: 90 percent / 48percent aq. HBr / 3 h / Heating

With hydrogen bromide;

DOI:10.1021/jm00384a006

Reference yield:

2-(3,4-dimethoxyphenyl)-ethylamine (120-20-7) → 7,8-Dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine Hydrobromide (20012-10-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 42 percent / 16 h / 90 - 100 °C

2: 90 percent / 48percent aq. HBr / 3 h / Heating

With hydrogen bromide;

DOI:10.1021/jm00384a006

upstream raw materials:

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenyl-2-hydroxyethylamine

styrene oxide

2-(3,4-dimethoxyphenyl)-ethylamine

Downstream raw materials:

SKF 77434

3-formyl-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine

(R,S)-7,8-dihydroxy-1H-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine

3-allyl-6,9-dichloro-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine