ChemicalBook--->CAS DataBase List--->1126795-00-3

1126795-00-3

1126795-00-3 Structure

1126795-00-3 Structure
IdentificationBack Directory
[Name]

3-Oxa-9-azabicyclo[3.3.1]nonan-7-one Hydrochloride
[CAS]

1126795-00-3
[Synonyms]

3-Oxa-9-azabicyclo[3.3.1]nonan-7-one Hydrochloride
3-Oxa-9-azabicyclo[3.3.1]nonan-7-one, hydrochloride (1:1)
[Molecular Formula]

C7H12ClNO2
[MDL Number]

MFCD20491410
[MOL File]

1126795-00-3.mol
[Molecular Weight]

177.629
Chemical PropertiesBack Directory
[storage temp. ]

Inert atmosphere,Room Temperature
[Appearance]

white solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Spectrum DetailBack Directory
[Spectrum Detail]

3-Oxa-9-azabicyclo[3.3.1]nonan-7-one Hydrochloride(1126795-00-3)1HNMR
Hazard InformationBack Directory
[Synthesis]

9-Boc-7-oxa-9-azabicyclo[3.3.1]nonan-3-one

280761-97-9

3-Oxa-9-azabicyclo[3.3.1]nonan-7-one Hydrochloride

1126795-00-3

The general procedure for the synthesis of 3-oxa-9-azabicyclo[3.3.1]nonan-7-one hydrochloride from 9-Boc-7-oxa-9-azabicyclo[3.3.1]nonan-3-one was as follows: tert-butyl 7-oxo-3-oxa-9-azabicyclo[3.3.1]nonane-9-carboxylate A3 (160 mg, 0.66 mmol) was dissolved in Et2O ( 3 M solution, 3 mL) in HCl was added.The reaction mixture was stirred at room temperature for 2-3 hrs. After completion of the reaction, the mixture was concentrated and the crude product obtained was washed with ether to give the target product 3-oxa-9-azabicyclo[3.3.1]nonan-7-one hydrochloride as a yellow solid (120 mg, 100% yield).LCMS analysis results: retention time (RT) 0.24 min, m/z 142.1 [M + H]+.

[References]

[1] Patent: WO2017/153519, 2017, A1. Location in patent: Page/Page column 65; 66
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