1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride

Base Information Edit

Chemical Name:1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride
CAS No.:86215-36-3
Molecular Formula:C11H11 Cl2 N . Cl H
Molecular Weight:264.582
Hs Code.:
European Community (EC) Number:662-650-7
ChEMBL ID:CHEMBL543929
Mol file:86215-36-3.mol

Synonyms:1-(3,4-dichlorophenyl)-3-azabicyclo-(3.1.0)hexane hydrochloride;amitifadine;DOV 21,947;DOV 216,303;DOV 216303;DOV 21947;DOV-21947;DOV21947;EB-1010

Suppliers and Price of 1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride

Supply Marketing:Edit

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

Sigma-Aldrich
DOV 216,303 ≥98% (HPLC)
5mg
$ 138.00

Sigma-Aldrich
DOV 216,303 ≥98% (HPLC)
25mg
$ 608.00

Activate Scientific
1-(3,4-Dichlorophenyl)-3-azabicyclo[3.1.0]hexane HCl 95+%
1 g
$ 425.00

ACHEMBLOCK
1-(3,4-Dichlorophenyl)-3-azabicyclo[3.1.0]hexanehydrochloride 97%
5G
$ 1245.00

ACHEMBLOCK
1-(3,4-Dichlorophenyl)-3-azabicyclo[3.1.0]hexanehydrochloride 97%
1G
$ 365.00

Total 7 raw suppliers

Chemical Property of 1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride Edit

Chemical Property:

Vapor Pressure:0.000246mmHg at 25°C
Boiling Point:324.4°C at 760 mmHg
Flash Point:150°C
Storage Temp.:?20°C
Solubility.:DMSO: ≥10mg/mL
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:263.003532
Heavy Atom Count:15
Complexity:245

Purity/Quality:

NLT 98% ^*data from raw suppliers

DOV 216,303 ≥98% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s): T
Hazard Codes:T
Statements: 25-36
Safety Statements: 26-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1C2C1(CNC2)C3=CC(=C(C=C3)Cl)Cl.Cl

Technology Process of 1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride

There total 11 articles about 1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride 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:

: 66504-44-7
(±)-1-(3,4 dichlorophenyl)-3-azabicyclo[3.1.0]-hexane-2,4-dione

: 86215-36-3,410074-74-7
(+/-)-1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0.]hexane hydrochloride

Guidance literature:: (±)-1-(3,4 dichlorophenyl)-3-azabicyclo[3.1.0]-hexane-2,4-dione; With borane-THF; In tetrahydrofuran; Heating / reflux;

With hydrogenchloride; water; In tetrahydrofuran; at 10 - 20 ℃; for 1h; pH=2;

Reference yield:

: borane tetrahydrofuran

: 67644-29-5
1-(4-chlorophenyl)-3-azabicyclo[3.1.0]hexane

: 66504-40-3
1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane

: 86215-36-3,410074-74-7
(+/-)-1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0.]hexane hydrochloride

Guidance literature:: With hydrogenchloride; sodium hydroxide; In tetrahydrofuran;

Reference yield:

: 163339-71-7
α-bromo-3,4-dichlorophenylacetic acid methyl ester

: 86215-36-3,410074-74-7
(+/-)-1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0.]hexane hydrochloride

Guidance literature:: Multi-step reaction with 4 steps

1.1: potassium methanolate / toluene / -5 - 10 °C / Inert atmosphere; Industry scale

2.1: sodium hydroxide / isopropyl alcohol; methanol / 20 - 60 °C / Industry scale

2.2: 30 - 35 °C / Industry scale

3.1: urea / xylene / 6 h / Reflux

4.1: borane-THF / tetrahydrofuran / 1.25 h / 0 °C / Inert atmosphere; Steam bath

4.2: Cooling with ice

With borane-THF; potassium methanolate; urea; sodium hydroxide; In tetrahydrofuran; methanol; isopropyl alcohol; toluene; xylene;