ChemicalBook > CAS DataBase List > 1-(5-Bromo-2-methoxy-phenyl)adamantane

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
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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)
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Safety

Hazard Codes 
Xi
Hazard Note 
Irritant
HS Code 
2909309090
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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.

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N-Bromosuccinimide Price

TCI Chemical
Product number
A2321
Product name
2-(1-Adamantyl)-4-bromoanisole
Purity
>98.0%(GC)
Packaging
5g
Price
$132
Updated
2025/07/31
TCI Chemical
Product number
A2321
Product name
2-(1-Adamantyl)-4-bromoanisole
Purity
>98.0%(GC)
Packaging
25g
Price
$460
Updated
2025/07/31
TRC
Product number
A208300
Product name
2-(1-Adamantyl)-4-bromoanisole
Packaging
250mg
Price
$60
Updated
2021/12/16
AK Scientific
Product number
J91523
Product name
2-(1-Adamantane)-4-bromoanisole
Packaging
1g
Price
$20
Updated
2021/12/16
ChemScene
Product number
CS-W009894
Product name
1-(5-Bromo-2-methoxyphenyl)adamantane
Packaging
10g
Price
$55
Updated
2021/12/16
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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

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1-(5-Bromo-2-methoxy-phenyl)adamantane Suppliers

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View Lastest Price from 1-(5-Bromo-2-methoxy-phenyl)adamantane manufacturers

Shanghai Qyubiotech Co., Ltd.
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
Hebei Chuanghai Biotechnology Co., Ltd
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
Henan Aochuang Chemical Co.,Ltd.
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

104224-63-7, 1-(5-Bromo-2-methoxy-phenyl)adamantaneRelated Search:

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  • 1-(5-BROMO-2-METHOXYPHENYL)TRYCYCLO[3,3,1,13,7]DECANE
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  • 1-(5-bromo-2-methoxyphenyl)-
  • 2-(1-adamantanyl)-4-bromoanisole
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  • 2-(1-Adamantyl)-4-bromoanisole &gt
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  • CAS:104224-63-7
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  • 104224-63-7
  • 4224-63-7
  • C17H22BrO
  • C17H21BrO
  • API
  • Aromatics
  • Intermediates & Fine Chemicals
  • Metabolites & Impurities
  • Pharmaceuticals
  • Intermediates of Adapalene
  • Adamantane derivatives
  • APIs Intermediate
  • blocks
  • Bromides
  • ADAPALENE
  • (intermediate of adapalene)