6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol

Base Information

Chemical Name:6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol
CAS No.:80751-67-3
Molecular Formula:C₂₁H₂₀ClNO₃
Molecular Weight:369.848
Hs Code.:
ChEMBL ID:CHEMBL1190650
DSSTox Substance ID:DTXSID401131111

Synonyms:CHEMBL1190650;DTXSID401131111;6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol;80751-67-3

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:369.1131712
Heavy Atom Count:26
Complexity:459

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CN(CC(C2=CC(=C(C(=C21)Cl)O)O)C3=CC=CC=C3)CC4=CC=CO4

Technology Process of 6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol

There total 6 articles about 6-Chloro-3-(2-furanylmethyl)-2,3,4,5-tetrahydro-1-phenyl-1H-3-benzazepine-7,8-diol 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:

: 67287-76-7
(6-Chloro-7,8-dihydroxy-1-phenyl-1,2,4,5-tetrahydro-benzo[d]azepin-3-yl)-furan-2-yl-methanone

: 80751-67-3
6-Chloro-3-furan-2-ylmethyl-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol

Guidance literature:: With borane; In tetrahydrofuran; at 25 ℃; for 3h;
DOI:10.1021/jm00346a005

Reference yield:

: 88-14-2
2-furanoic acid

: 80751-67-3
6-Chloro-3-furan-2-ylmethyl-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol

Guidance literature:: Multi-step reaction with 4 steps

1: DCC / tetrahydrofuran

2: NaHCO₃ / H₂O; 2-methoxy-ethanol / 4 h / 25 °C

3: BBr₃ / CH₂Cl₂ / 1 h / 25 °C

4: 1 M BH₃ / tetrahydrofuran / 3 h / 25 °C

With borane; boron tribromide; sodium hydrogencarbonate; dicyclohexyl-carbodiimide; In tetrahydrofuran; dichloromethane; 2-methoxy-ethanol; water;
DOI:10.1021/jm00346a005

Reference yield:

: 67287-37-0
N-(2-Hydroxy-2-phenethyl)-N-<2-(2'-chlor-3',4'-dimethoxyphenyl)-ethyl>-amin

: 80751-67-3
6-Chloro-3-furan-2-ylmethyl-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol

Guidance literature:: Multi-step reaction with 4 steps

1: H₂SO₄, CF₃COOH / 2 h / Heating

2: NaHCO₃ / H₂O; 2-methoxy-ethanol / 4 h / 25 °C

3: BBr₃ / CH₂Cl₂ / 1 h / 25 °C

4: 1 M BH₃ / tetrahydrofuran / 3 h / 25 °C

With sulfuric acid; borane; boron tribromide; sodium hydrogencarbonate; trifluoroacetic acid; In tetrahydrofuran; dichloromethane; 2-methoxy-ethanol; water;
DOI:10.1021/jm00346a005