1-Boc-4-cyanopiperidine
- Product Name
- 1-Boc-4-cyanopiperidine
- CAS No.
- 91419-52-2
- Chemical Name
- 1-Boc-4-cyanopiperidine
- Synonyms
- TERT-BUTYL 4-CYANOPIPERIDINE-1-CARBOXYLATE;tert-Butyl 4-Cyano-1-piperidinecarboxylate;1-Boc-4-cyanopiperid;Boc-4-cyanopiperidine;N-boc-4-cyanopiperidie;1-Boc-4-cynopiperidine;1-BOC-4-CYANOPIPERIDINE;N-Boc 4-cyano piperdine;N-BOC-4-CYANO-PIPERIDINE;1-N-BOC-4-CYANO-PIPERIDINE
- CBNumber
- CB9684610
- Molecular Formula
- C11H18N2O2
- Formula Weight
- 210.27
- MOL File
- 91419-52-2.mol
1-Boc-4-cyanopiperidine Property
- Melting point:
- 60-63 °C
- Boiling point:
- 325.3±35.0 °C(Predicted)
- Density
- 1.07±0.1 g/cm3(Predicted)
- storage temp.
- 2-8°C
- solubility
- Chloroform
- pka
- -3.08±0.40(Predicted)
- form
- Crystalline Powder
- color
- White to off-white
- InChI
- InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13/h9H,4-7H2,1-3H3
- InChIKey
- UQADQTBQNVARAP-UHFFFAOYSA-N
- SMILES
- N1(C(OC(C)(C)C)=O)CCC(C#N)CC1
- CAS DataBase Reference
- 91419-52-2(CAS DataBase Reference)
Safety
- Hazard Codes
- Xn,N
- Risk Statements
- 20/21/22-50-36-22
- Safety Statements
- 36-36/37/39-61-26
- RIDADR
- 3439
- WGK Germany
- 3
- Hazard Note
- Harmful
- HazardClass
- 6.1
- PackingGroup
- III
- HS Code
- 29333990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H312Harmful in contact with skin
H315Causes skin irritation
H319Causes serious eye irritation
H331Toxic if inhaled
H400Very toxic to aquatic life
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P270Do not eat, drink or smoke when using this product.
P271Use only outdoors or in a well-ventilated area.
P273Avoid release to the environment.
P280Wear protective gloves/protective clothing/eye protection/face protection.
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.
P403+P233Store in a well-ventilated place. Keep container tightly closed.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- 696447
- Product name
- N-Boc-piperidine-4-carbonitrile
- Purity
- 97%
- Packaging
- 1g
- Price
- $46.41
- Updated
- 2025/07/31
- Product number
- B3962
- Product name
- 1-tert-Butoxycarbonyl-4-cyanopiperidine
- Purity
- >97.0%(GC)
- Packaging
- 1g
- Price
- $63
- Updated
- 2025/07/31
- Product number
- B3962
- Product name
- 1-tert-Butoxycarbonyl-4-cyanopiperidine
- Purity
- >97.0%(GC)
- Packaging
- 5g
- Price
- $214
- Updated
- 2025/07/31
- Product number
- 071968
- Product name
- 1-Boc-4-Cyanopiperidine
- Purity
- 95+%
- Packaging
- 5g
- Price
- $24
- Updated
- 2021/12/16
- Product number
- J52112
- Product name
- 1-N-Boc-4-cyanopiperidine
- Packaging
- 5g
- Price
- $25
- Updated
- 2021/12/16
1-Boc-4-cyanopiperidine Chemical Properties,Usage,Production
Chemical Properties
Yellowish Oil
Uses
Reactant for synthesis of:
- Aminomethylated fluoropiperidines
- Protein kinase B inhibitors
- GlyT1 inhibitors
- Piperidinecarboxylic acids via nitrilase-catalyzed enantioselective synthesis
Reactant for
- Replacement in CB2 receptor inhibitors
- Double addition reactions of methyllithium and n-butyllithium to unsaturated nitriles
Synthesis
91419-48-6
91419-52-2
The general procedure for the synthesis of N-Boc-4-cyanopiperidine from tert-butyl 4-carbamoylpiperidine-1-carboxylate is as follows: to a solution of ethyl acetate (EtOAc, 1 mL, 1 M) containing an aldoxime or amide (1.0 mmol) and triethylamine (Et3N, 1.5 mmol) was added batchwise to XtalFluor-E (1.1 mmol) at room temperature. ). The reaction mixture was stirred at room temperature for 1 hour. Subsequently, the reaction was quenched with saturated sodium bicarbonate (NaHCO3) solution and extracted with aqueous sodium carbonate (Na2CO3) and dichloromethane (CH2Cl2, 2 × 10 mL). The combined organic layers were washed sequentially with water and brine, dried over anhydrous magnesium sulfate (MgSO4) and concentrated under reduced pressure to give the crude product. If necessary, the crude product can be purified by fast column chromatography.
References
[1] Synthesis (Germany), 2015, vol. 47, # 23, p. 3758 - 3766
[2] Patent: WO2004/2483, 2004, A1. Location in patent: Page/Page column 21-22; 39-40
[3] Chemistry of Heterocyclic Compounds, 2009, vol. 45, # 12, p. 1503 - 1507
[4] European Journal of Medicinal Chemistry, 1984, vol. 19, # 2, p. 181 - 186
[5] Chemical and Pharmaceutical Bulletin, 2001, vol. 49, # 7, p. 822 - 829
1-Boc-4-cyanopiperidine Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 1-Boc-4-cyanopiperidine manufacturers
- Product
- 1-Boc-4-cyanopiperidine 91419-52-2
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 1Ton
- Release date
- 2022-10-17
- Product
- 1-Boc-4-cyanopiperidine 91419-52-2
- Price
- US $0.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 10000KGS
- Release date
- 2025-02-23
- Product
- 1-Boc-4-cyanopiperidine 91419-52-2
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 99.0%min GC
- Supply Ability
- 20-40tons/year
- Release date
- 2022-01-11