868049-49-4

Basic information

• Product Name: 6-Hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-2H-1,4-benzoxazin-3(4H)-one
• Synonyms: 6-Hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-2H-1,4-benzoxazin-3(4H)-one;Olodaterol;Olodaterol ImpurityＡ;2H-1,4-Benzoxazin-3(4H)-one, 6-hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-;BI 1744(Olodaterol;Striverdi Respimat);BI-1744;Striverdi
• CAS NO: 868049-49-4
• Molecular Formula: C₂₁H₂₆N₂O₅
• Molecular Weight: 386.44
• EINECS: 1592732-453-0
• Mol File: 868049-49-4.mol

Chemical Properties

• Boiling Point: 649.05 °C at 760 mmHg
• Flash Point: 346.333 °C
• Appearance: /
• Density: 1.250
• PKA: 9.42±0.20(Predicted)
• CAS DataBase Reference: 6-Hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-2H-1,4-benzoxazin-3(4H)-one(CAS DataBase Reference)
• NIST Chemistry Reference: 6-Hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-2H-1,4-benzoxazin-3(4H)-one(868049-49-4)
• EPA Substance Registry System: 6-Hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-2H-1,4-benzoxazin-3(4H)-one(868049-49-4)

Safety Data

• Hazardous Substances Data: 868049-49-4(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
Olodaterol is used as a bronchodilator for the long-term treatment of airflow obstruction in patients with chronic obstructive pulmonary disease (COPD), including chronic bronchitis and/or emphysema. It is delivered via the Respimat Soft Mist inhaler and has been approved for use in Russia, Canada, and the European Union.
Used in Drug Synthesis:
The synthesis of olodaterol proceeds through an (R)-styrene epoxide that is prepared via enantioselective reduction of an α-chloroketone intermediate. Ring opening of the epoxide with 1-(4-methoxyphenyl)-2-methylpropan-2-amine provides olodaterol. This synthesis process is used in the pharmaceutical industry to produce olodaterol for medical use.

Originator

Boehringer-Ingelheim (European Union)

Upstream product

• 869478-11-5 6-benzyloxy-8-((R)-2-chloro-1-hydroxyethyl)-4H-benzo[1,4]-oxazin-3-one 
• 869477-96-3 Olodaterol hydrochloride 
• 869478-13-7 6-benzyloxy-8-{(R)-1-hydroxy-2-[2-(4-methoxyphenyl)-1,1-dimethylethylamino]ethyl}-4H-benzo[1,4]oxazin-3-one 

Downstream Products

• 869477-96-3 Olodaterol hydrochloride 

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