2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE
- Product Name
- 2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE
- CAS No.
- 230615-52-8
- Chemical Name
- 2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE
- Synonyms
- hydrochloride (1:1);10-azatricyclo[6.3.1.02?]dodeca-2(7),3,5-triene;2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine HCl;2,3,4,5-Tetrahydro-1,5-methano-1H-3-benzazepine hydrochloride;2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE;2,3,4,5-tetrahydro-1H-1,5-methano-3-benzazepin-3-ium chloride;2,3,4,5-tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride;2,3,4,5-tetrahydro-1,5-Methano-1H-3-benzazepine,hydrochlorid...;2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepine (hydrochlortde);1,5-Methano-1H-3-benzazepine, 2,3,4,5-tetrahydro-, hydrochloride
- CBNumber
- CB81472880
- Molecular Formula
- C11H13N.HCl
- Formula Weight
- 195.69
- MOL File
- 230615-52-8.mol
2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE Property
- Melting point:
- >230°C (dec.)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Slightly, Heated), Methanol (Slightly)
- form
- Solid
- color
- Off-White to Pale Yellow
- InChI
- InChI=1/C11H13N.ClH/c1-2-4-11-9-5-8(6-12-7-9)10(11)3-1;/h1-4,8-9,12H,5-7H2;1H/t8-,9+;
- InChIKey
- WWJDLIUDQHFAGC-UFIFRZAQNA-N
- SMILES
- C1[C@@]2(C3=C(C=CC=C3)[C@@]([H])(C2)CN1)[H].Cl |&1:1,8,r|
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H351Suspected of causing cancer
- Precautionary statements
-
P201Obtain special instructions before use.
P202Do not handle until all safety precautions have been read and understood.
P281Use personal protective equipment as required.
P308+P313IF exposed or concerned: Get medical advice/attention.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- T295580
- Product name
- 2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepineHydrochloride
- Packaging
- 100mg
- Price
- $95
- Updated
- 2021/12/16
- Product number
- CS-B0003
- Product name
- 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepinehydrochloride
- Purity
- 99.99%
- Packaging
- 1g
- Price
- $105
- Updated
- 2021/12/16
- Product number
- CS-B0003
- Product name
- 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepinehydrochloride
- Purity
- 99.99%
- Packaging
- 5g
- Price
- $278
- Updated
- 2021/12/16
- Product number
- CS-B0003
- Product name
- 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepinehydrochloride
- Purity
- 99.99%
- Packaging
- 10g
- Price
- $336
- Updated
- 2021/12/16
- Product number
- 1494AB
- Product name
- 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepinehydrochloride
- Packaging
- 10g
- Price
- $437
- Updated
- 2021/12/16
2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE Chemical Properties,Usage,Production
Uses
2,3,4,5-Tetrahydro-1H-1,5-methano-3-benzazepine Hydrochloride is used in the preparation of the main band impurity of Varenicline (V098490), a nicotinic α4β2 acetylcholine receptor partial agonist. Aid in smoking cessation.
Synthesis
230615-48-2
230615-52-8
The general procedure for the synthesis of 2,3,4,5-tetrahydro-3-benzyl-1,5-methano-1H-3-benzazepine hydrochloride from 2,3,4,5-tetrahydro-3-benzyl-1,5-methanolbenzo[d]azepine hydrochloride is as follows: methanol hydrochloride (116.6 g, 13.8%) was slowly added to 10-benzyl-10-azabenzotriene at 0°C to 5°C [ 6.3.1.02,7]dodeca-2(7),3,5-triene (100 g) in a methanol (600 ml) suspension. Subsequently, the reaction mixture was subjected to hydrogenation reaction catalyzed by 20% palladium hydroxide (26 g) under hydrogen pressure of 5 to 6 kg/cm2 at 20°C to 40°C for 3 to 6 hours. The reaction process was monitored by HPLC. After completion of the reaction, the mixture was filtered through a diatomaceous earth pad and the filtrate was distilled under reduced pressure to remove the solvent. Dichloromethane (500 ml) was added to the residue and the solvent was again completely evaporated under reduced pressure to give the crude product. The crude product was purified by recrystallization with acetone (450 ml) to finally obtain high purity 10-aza-tricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene hydrochloride (HPLC purity 98.23%, yield 89.24%).
References
[1] Patent: US2009/318695, 2009, A1. Location in patent: Page/Page column 9
[2] Patent: WO2010/23561, 2010, A1. Location in patent: Page/Page column 16
2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE manufacturers
- Product
- 2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE 230615-52-8
- Price
- US $2.00-5.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 100kg
- Release date
- 2025-06-25
- Product
- 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine HCl 230615-52-8
- Price
- US $1200.00/g
- Min. Order
- 1g
- Purity
- 98
- Supply Ability
- 500 Kg
- Release date
- 2024-02-10
- Product
- 2,3,4,5-TETRAHYDRO-1H-1,5-METHANO-3-BENZAZEPINE HYDROCHLORIDE 230615-52-8
- Price
- US $0.00-0.00/kg
- Min. Order
- 0.1kg
- Purity
- 99.0%min
- Supply Ability
- 200kg
- Release date
- 2023-06-09