1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER
- Product Name
- 1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER
- CAS No.
- 147804-30-6
- Chemical Name
- 1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER
- Synonyms
- t-Butyl 1-Oxa-6-azaspiro[2.5]octane-6-carboxylate;N-Boc-1-oxa-6-azaspiro[2.5]octane;6-Boc-1-oxa-6-azaspiro[2.5]octane,97%;1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID;N-Boc-1-Oxa-6-azaspiro[2.5]octane-6-carboxylic acid;6-(tert-Butoxycarbonyl)-1-oxa-6-azaspiro[2.5]octane;tert-Butyl 1-oxa-6-azaspiro[2.5]octan-6-carboxylate;6-Aza-1-oxaspiro[2.5]octane-6-carboxylic acid tert-butyl ester;1-Oxa-6-aza-spiro[2.5]octan-6-carboxylic acid tert-butyl ester;2-oxa-6-azaspiro[2.5]octane-6-carboxylic acid tert-butyl ester
- CBNumber
- CB5704293
- Molecular Formula
- C11H19NO3
- Formula Weight
- 213.27
- MOL File
- 147804-30-6.mol
1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER Property
- Melting point:
- 50-52℃
- Boiling point:
- 297.6±33.0 °C(Predicted)
- Density
- 1.12
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- -0.82±0.20(Predicted)
- form
- Crystalline Powder
- color
- White
- InChI
- InChI=1S/C11H19NO3/c1-10(2,3)15-9(13)12-6-4-11(5-7-12)8-14-11/h4-8H2,1-3H3
- InChIKey
- ULSBMKGFFFMGOI-UHFFFAOYSA-N
- SMILES
- O1C2(CCN(C(OC(C)(C)C)=O)CC2)C1
Safety
- Hazard Codes
- Xi
- Risk Statements
- 36/37/38
- Safety Statements
- 22-26-36/37/39-45
- HazardClass
- IRRITANT
- HS Code
- 29349990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405Store locked up.
N-Bromosuccinimide Price
- Product number
- SYX00064
- Product name
- 1-Oxa-6-azaspiro[2.5]octane-6-carboxylic acid tert-butyl ester
- Purity
- Aldrich
- Packaging
- 1g
- Price
- $403
- Updated
- 2025/07/31
- Product number
- B5501
- Product name
- tert-Butyl 1-Oxa-6-azaspiro[2.5]octane-6-carboxylate
- Purity
- >97.0%(GC)
- Packaging
- 1g
- Price
- $142
- Updated
- 2025/07/31
- Product number
- B5501
- Product name
- tert-Butyl 1-Oxa-6-azaspiro[2.5]octane-6-carboxylate
- Purity
- >97.0%(GC)
- Packaging
- 5g
- Price
- $423
- Updated
- 2025/07/31
- Product number
- O845605
- Product name
- 1-Oxa-6-azaspiro[2.5]octane-6-carboxylic acid tert-butyl ester
- Packaging
- 1g
- Price
- $60
- Updated
- 2021/12/16
- Product number
- O845605
- Product name
- 1-Oxa-6-azaspiro[2.5]octane-6-carboxylic acid tert-butyl ester
- Packaging
- 5g
- Price
- $140
- Updated
- 2021/12/16
1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER Chemical Properties,Usage,Production
Uses
1-Oxa-6-azaspiro[2.5]octane-6-carboxylic Acid tert-Butyl Ester is used in the synthesis of a T-type Ca2+ channel antagonist, 4-Aminomethyl-4-fluoropiperidine.
Synthesis
79099-07-3
147804-30-6
General procedure for the synthesis of tert-butyl 1-oxa-6-azaspiro[2.5]octane-6-carboxylate from N-tert-butoxycarbonyl-4-piperidone: [Reference Example 1] Synthesis of tert-butyl 6-azaspiro[2.5]octane-6-carboxylate. 60% NaH-oil packet (5.28 g, 132 mmol) was suspended in dimethylsulfoxide (DMSO) (250 mL) and after cooling to 0°C, trimethylsulfonium iodide (29.0 g, 132 mmol) was added. The reaction mixture was warmed to room temperature and stirred for 40 min. Subsequently, N-Boc-4-piperidone (Boc = tert-butoxycarbonyl) (25.0 g, 125 mmol) was added and the reaction mixture was stirred at room temperature for 1 hr and then at 55 °C for 1.5 hrs. After completion of the reaction, the mixture was poured into ice-cooled water (500 mL) and extracted with ethyl acetate (AcOEt) (500 mL × 3 times). The ethyl acetate layers were combined, washed with water, then with saturated brine and finally dried with anhydrous Na2SO4. After filtration, the filtrate was concentrated to give tert-butyl 6-aza-1-oxaspiro[2.5]octane-6-carboxylate. The product was structurally confirmed by 1H-NMR. The yield was 26.4 g (99%).1H-NMR (270 MHz, CDCl3): δ 1.40-1.49 (m, 2H), 1.46 (s, 9H), 1.74-1.85 (m, 2H), 2.69 (s, 2H), 3.37-3.48 (m, 2H), 3.68-3.77 (m, 2H).
References
[1] Patent: EP1505067, 2005, A1. Location in patent: Page/Page column 368
[2] Patent: WO2008/10765, 2008, A1. Location in patent: Page/Page column 66-67
[3] Patent: US2010/4239, 2010, A1. Location in patent: Page/Page column 93
[4] Patent: WO2005/49620, 2005, A1. Location in patent: Page/Page column 24
[5] Patent: CN108727400, 2018, A. Location in patent: Paragraph 0115; 0118; 0120
1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER manufacturers
- Product
- tert-Butyl 1-oxa-6-azaspiro[2.5]octane-6-carboxylate 147804-30-6
- Price
- US $1.60-6.60/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 100kg
- Release date
- 2025-06-19
- Product
- 1-OXA-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER 147804-30-6
- Price
- US $1.00/kg
- Min. Order
- 1kg
- Purity
- 95%-99%
- Supply Ability
- 100kg
- Release date
- 2018-12-25