(3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER
- Product Name
- (3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER
- CAS No.
- 885280-38-6
- Chemical Name
- (3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER
- Synonyms
- 3-(Boc-aMino)cyclohexanone;3-N-BOC-AMINO CYCLOHEXANONE;3-(Boc-amino)cyclohexanone,95%;TERT-BUTYL 3-OXOCYCLOHEXYLCARBAMATE;tert-butyl N-(3-oxocyclohexyl)carbaMate;3-Aminocyclohexan-1-one, N-BOC protected;(3-Oxo-cyclohexyl)-carbaMic acid benzyl ester;2-Methyl-2-propanyl (3-oxocyclohexyl)carbamate;(3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER;Carbamic acid, (3-oxocyclohexyl)-, 1,1-dimethylethyl ester
- CBNumber
- CB2102577
- Molecular Formula
- C11H19NO3
- Formula Weight
- 213.27
- MOL File
- 885280-38-6.mol
(3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER Property
- Melting point:
- 81-85oC
- Boiling point:
- 335.9±31.0 °C(Predicted)
- Density
- 1.06±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Store in freezer, under -20°C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 12.01±0.20(Predicted)
- form
- Solid
- color
- Pale Beige
- InChI
- InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-8-5-4-6-9(13)7-8/h8H,4-7H2,1-3H3,(H,12,14)
- InChIKey
- VGDCXKATFLOEHF-UHFFFAOYSA-N
- SMILES
- C(OC(C)(C)C)(=O)NC1CCCC(=O)C1
- CAS DataBase Reference
- 885280-38-6
Safety
- HS Code
- 2922390090
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
- O849850
- Product name
- (3-Oxocyclohexyl)carbamicAcidtert-ButylEster
- Packaging
- 1g
- Price
- $140
- Updated
- 2021/12/16
- Product number
- 265715
- Product name
- 3-N-Boc-aminocyclohexanone
- Packaging
- 500mg
- Price
- $347
- Updated
- 2021/12/16
- Product number
- J51193
- Product name
- 3-N-Boc-Aminocyclohexanone
- Packaging
- 1g
- Price
- $35
- Updated
- 2021/12/16
- Product number
- 074452
- Product name
- 3-N-Boc-Aminocyclohexanone
- Purity
- 95+%
- Packaging
- 1g
- Price
- $39
- Updated
- 2021/12/16
- Product number
- OR301088
- Product name
- 3-Aminocyclohexan-1-one,N-BOCprotected
- Purity
- 97%
- Packaging
- 1g
- Price
- $51
- Updated
- 2021/12/16
(3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER Chemical Properties,Usage,Production
Uses
(3-Oxocyclohexyl)carbamic Acid tert-Butyl Ester is used to prepare (benzyloxy)benzamides as TRPM8 antagonists.
Synthesis
610302-03-9
885280-38-6
General procedure for the synthesis of N-Boc-3-cyclohexanone amine from tert-butyl 3-hydroxycyclohexylcarbamate: To a solution of tert-butyl (3-hydroxycyclohexyl)carbamate (4.40 g, 20.46 mmol) in dichloromethane (DCM, 250 mL) was added Dess-Martin periodinane (13.0 g, 30.70 mmol). The reaction mixture was cooled in an ice bath and then stirred at room temperature for 2 hours. After completion of the reaction, the reaction mixture was diluted with DCM and washed with aqueous sodium carbonate. The organic layer was separated and dried with anhydrous sodium sulfate and subsequently concentrated. The crude product was purified by silica gel column chromatography (eluent: 40% petroleum ether solution of ethyl acetate) to afford N-Boc-3-cyclohexanone amine (4.0 g, 18.78 mmol, 91% yield). Mass spectrum (ESI) m/z 214.1 [M + H]+.
References
[1] Patent: US2015/175557, 2015, A1. Location in patent: Paragraph 0383
[2] Patent: WO2016/44770, 2016, A1. Location in patent: Page/Page column 736
(3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER Preparation Products And Raw materials
Raw materials
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View Lastest Price from (3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER manufacturers
- Product
- 3-N-Boc-aminocyclohexanone 885280-38-6
- Price
- US $570.00-500.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 5mt
- Release date
- 2025-06-08
- Product
- (3-OXO-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER 885280-38-6
- Price
- US $2.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- customise
- Release date
- 2018-08-09