tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate

tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate Suppliers list

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Products Intro:	Product Name:3-Boc-3,8-diaza-bicyclo[3.2.1]octane CAS:201162-53-0 Purity:NLT 98% Package:1G;1KG;100KG

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tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate manufacturers

tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate Basic information

Product Name:	tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate
Synonyms:	tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate;3-Boc-3,8-diazabicyclo[3.2.1]octane;3,8-Diazabicyclo[3.2.1]octane-3-carboxylic acid tert-butyl ester;3-Boc-3,8-diaza-bicyclo[3...;tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylat;3,8-Diazabicyclo[3.2.1]octane-3-carboxylic acid, 1,1-dimethylethyl ester;3,8-Diazabicyclo[3.2.1]octane,N-BOCprotected;8-diazabicyclo[3.2.1]octane-3-carboxylate
CAS:	201162-53-0
MF:	C11H20N2O2
MW:	212.29
EINECS:
Product Categories:	CHIRAL CHEMICALS
Mol File:	201162-53-0.mol

tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate Chemical Properties

Boiling point	295.4±15.0 °C(Predicted)
density	1.076
storage temp.	2-8°C(protect from light)
pka	9.80±0.20(Predicted)
form	solid
color	White
InChI	InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-8-4-5-9(7-13)12-8/h8-9,12H,4-7H2,1-3H3
InChIKey	PSDAEKDIOQXLLC-UHFFFAOYSA-N
SMILES	C12NC(CC1)CN(C(OC(C)(C)C)=O)C2

Safety Information

HS Code

2933998090

MSDS Information

tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate Usage And Synthesis

Uses	tert-Butyl 3,8-Diazabicyclo[3.2.1]octane-3-carboxylate is used in preparation of substituted pyrrolo[2,3-b]pyridines for suppressing toxic endoplasmic reticulum stress.
Synthesis	201162-52-9 201162-53-0 The general procedure for the synthesis of tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate from tert-butyl 8-benzyl-3,8-diazabicyclo[3.2.1]octane-3-carboxylate was as follows: the product of Example 23A (0.62 g, 0.12 mmol) was dissolved in ethanol (10 mL) and palladium/carbon (Aldrich, 60 mg, 10 wt%) as a catalyst. The reaction was stirred at room temperature for 18 h under an atmosphere of hydrogen (balloon) at 1 atm. Upon completion of the reaction, the reaction mixture was filtered to remove the catalyst and the filtrate was concentrated under reduced pressure to remove the solvent. The resulting crude product was purified by silica gel column chromatography with an eluent ratio of 1% ammonia:9% methanol:90% dichloromethane to afford tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate, the target compound (0.44 g, 100% yield). Mass spectral analysis (DC1/NH3) showed m/z 213 (M + H)+.
References	[1] Journal of Medicinal Chemistry, 1998, vol. 41, # 5, p. 674 - 681 [2] Patent: US2005/101602, 2005, A1. Location in patent: Page/Page column 35 [3] Patent: US2005/9841, 2005, A1. Location in patent: Page/Page column 16 [4] Patent: US2005/80095, 2005, A1. Location in patent: Page/Page column 19

tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate Preparation Products And Raw materials

Raw materials	tert-butyl 8-benzyl-3,8-diaza-bicyclo[3.2.1]octane-3-carboxylate-->Ethanol-->Hydrogen-->8-Benzyl-3,8-diaza-bicyclo[3.2.1]octane
Preparation Products	tert-butyl 8-benzyl-3,8-diaza-bicyclo[3.2.1]octane-3-carboxylate

Tag:tert-butyl 3,8-diazabicyclo[3.2.1]octane-3-carboxylate(201162-53-0) Related Product Information

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