exo-3-AMino-9-Boc-9-azabi...

Base Information

• Chemical Name: exo-3-AMino-9-Boc-9-azabi...
• CAS No.: 1363380-67-9
• Molecular Formula: C₁₃H₂₄N₂O₂
• Molecular Weight: 240.346
• Hs Code.: 2933990090
• Mol file: 1363380-67-9.mol

Synonyms:exo-3-AMino-9-Boc-9-azabi...;exo-3-aMino-9-boc-9-azabicyclo[3.3.1]nonane;(3-exo)-tert-Butyl 3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate;tert-butyl exo-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate

Chemical Property of exo-3-AMino-9-Boc-9-azabi...

Chemical Property:

• Boiling Point: 331.1±35.0 °C(Predicted)
• PKA: 10.12±0.20(Predicted)
• PSA: 55.56000
• Density: 1.061±0.06 g/cm3(Predicted)
• LogP: 2.90390

Purity/Quality:

98%,99%, ^*data from raw suppliers

exo-3-Amino-9-Boc-9-azabicyclo[3.3.1]nonane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of exo-3-AMino-9-Boc-9-azabi...

There total 2 articles about exo-3-AMino-9-Boc-9-azabi... which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 86.0%

(1R,5S,E)-tert-butyl 3-(hydroxyimino)-9-azabicyclo[3.3.1]nonane-9-carboxylate → tert-butyl (1R,5S)-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate (1887167-87-4,202797-03-3,1363380-67-9)

Guidance literature:

With hydrogen; In methanol; at 20 ℃; for 7h; under 1520.1 Torr;

Reference yield:

(1R,5S)-tert-butyl 3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate → tert-butyl (1R,5S)-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate (1887167-87-4,202797-03-3,1363380-67-9)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydroxide; hydroxylamine hydrochloride / ethanol; water / 8 h / 20 - 95 °C / Inert atmosphere

2: hydrogen / methanol / 7 h / 20 °C / 1520.1 Torr

With hydroxylamine hydrochloride; hydrogen; sodium hydroxide; In methanol; ethanol; water;

Reference yield:

tert-butyl (1R,5S)-3-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate (1887167-87-4,202797-03-3,1363380-67-9) + (S)-6-(carboxymethyl)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine hydrochloride (1426257-60-4) → (1R,5S)-tert-butyl 3-({2-[(S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetyl}amino)-9-azabicyclo[3.3.1]nonane-9-carboxylate

Guidance literature:

With triethylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; at 20 ℃; for 16h;

Downstream raw materials:

(endo)-3-amino-9-methyl-9-azabicyclo[3.3.1]-nonane

Refernces