1-(5-Bromo-2-methoxy-phenyl)adamantane
- Product Name
- 1-(5-Bromo-2-methoxy-phenyl)adamantane
- CAS No.
- 104224-63-7
- Chemical Name
- 1-(5-Bromo-2-methoxy-phenyl)adamantane
- Synonyms
- Adap-int A;CAS:104224-63-7;1-(5-Bromo-2-methoxy;Adapalene IMpurity J;2-Adamantyl-4-bromoanisole;1-(5-bromo-2-methoxyphenyl)-;2-(1-ADAMANTYL)-4-BROMOANISOLE;2-(1-ADAMANTANE)-4-BROMOANISOLE;2-(1-adamantanyl)-4-bromoanisole;(1 - ADMANTYL) - 4 BROMO ANISOLE
- CBNumber
- CB2339346
- Molecular Formula
- C17H21BrO
- Formula Weight
- 321.25
- MOL File
- 104224-63-7.mol
1-(5-Bromo-2-methoxy-phenyl)adamantane Property
- Melting point:
- 139-141°C
- Boiling point:
- 402.5±38.0 °C(Predicted)
- Density
- 1.346±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- White
- InChI
- InChI=1S/C17H21BrO/c1-19-16-3-2-14(18)7-15(16)17-8-11-4-12(9-17)6-13(5-11)10-17/h2-3,7,11-13H,4-6,8-10H2,1H3
- InChIKey
- QQAMHHZQONQBFZ-UHFFFAOYSA-N
- SMILES
- C12(C3=CC(Br)=CC=C3OC)CC3CC(CC(C3)C1)C2
- CAS DataBase Reference
- 104224-63-7(CAS DataBase Reference)
Safety
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2909309090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- A2321
- Product name
- 2-(1-Adamantyl)-4-bromoanisole
- Purity
- >98.0%(GC)
- Packaging
- 5g
- Price
- $132
- Updated
- 2025/07/31
- Product number
- A2321
- Product name
- 2-(1-Adamantyl)-4-bromoanisole
- Purity
- >98.0%(GC)
- Packaging
- 25g
- Price
- $460
- Updated
- 2025/07/31
- Product number
- A208300
- Product name
- 2-(1-Adamantyl)-4-bromoanisole
- Packaging
- 250mg
- Price
- $60
- Updated
- 2021/12/16
- Product number
- J91523
- Product name
- 2-(1-Adamantane)-4-bromoanisole
- Packaging
- 1g
- Price
- $20
- Updated
- 2021/12/16
- Product number
- CS-W009894
- Product name
- 1-(5-Bromo-2-methoxyphenyl)adamantane
- Packaging
- 10g
- Price
- $55
- Updated
- 2021/12/16
1-(5-Bromo-2-methoxy-phenyl)adamantane Chemical Properties,Usage,Production
Description
1-(5-Bromo-2-methoxy-phenyl)adamantane is an organic synthesis reagent for the preparation of the adapalene intermediate 6-bromo-2-naphthalenecarboxylate.
Chemical Properties
1-(5-Bromo-2-methoxy-phenyl)adamantane Appearance is white Solid or white to light yellow powder to crystalline, melting point 144℃.
Uses
Adapalene (A225000) impurity.
Synthesis
104224-68-2
74-88-4
104224-63-7
To a stirred mixture of anhydrous N,N-dimethylformamide (5 ml) containing 2-(1-adamantyl)-4-bromophenol (0.5 g; 1.62 mmol) and anhydrous potassium carbonate (0.335 g; 2.42 mmol), iodomethane (1 ml) was added. The reaction mixture was stirred at room temperature for 2 hours. After completion of the reaction, the mixture was diluted to 100 ml with distilled water and extracted with ethyl acetate (100 ml). The organic layers were combined, dried with anhydrous magnesium sulfate and filtered to remove the desiccant. The filtrate was filtered through silica gel column to remove impurities. Finally, the filtrate was concentrated to dryness under reduced pressure to give 1-(5-bromo-2-methoxyphenyl)adamantane (0.49 g, 94% yield) as a light yellow-green solid.1H-NMR (CDCl3) δ: 7.27-7.22 (m, 2H); 6.31 (d, 1H, J = 6.5 Hz); 3.78 (s, 3H); 2.04 (s, 10H). 1.74 (br, 5H).
References
[1] Patent: WO2010/43000, 2010, A1. Location in patent: Page/Page column 80
[2] Bioorganic and Medicinal Chemistry, 2007, vol. 15, # 14, p. 4863 - 4875
[3] European Journal of Medicinal Chemistry, 2014, vol. 79, p. 251 - 259
[4] Journal of Medicinal Chemistry, 1995, vol. 38, # 26, p. 4993 - 5006
[5] Patent: US4717720, 1988, A
1-(5-Bromo-2-methoxy-phenyl)adamantane Preparation Products And Raw materials
Raw materials
Preparation Products
1-(5-Bromo-2-methoxy-phenyl)adamantane Suppliers
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View Lastest Price from 1-(5-Bromo-2-methoxy-phenyl)adamantane manufacturers
- Product
- 1-(5-Bromo-2-methoxy-phenyl)adamantane 104224-63-7
- Price
- US $0.00-0.00/g
- Min. Order
- 10g
- Purity
- 98%+
- Supply Ability
- 100kgs per Month
- Release date
- 2022-10-17
- Product
- 1-(5-Bromo-2-methoxy-phenyl)adamantane 104224-63-7
- Price
- US $10.00/KG
- Min. Order
- 1KG
- Purity
- 98
- Supply Ability
- 1KG
- Release date
- 2024-11-26
- Product
- 1-(5-Bromo-2-methoxy-phenyl)adamantane 104224-63-7
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1Ton
- Release date
- 2022-09-19