1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE
- Product Name
- 1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE
- CAS No.
- 116247-92-8
- Chemical Name
- 1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE
- Synonyms
- 1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE;1-(2-pyrimidinyl)-2-piperidinone;4-Oxo-1-(pyrimidin-2-yl)piperidine;4-Piperidinone, 1-(2-pyrimidinyl)-;1-Pyrimidin-2-yl-piperidin-4-one95%;1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE 95%;1-(2-PYRIMIDINYL)TETRAHYDRO-4(1H)-PYRIDINONE;1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE ISO 9001:2015 REACH;4-Oxo-1-(pyrimidin-2-yl)piperidine, 2-(4-Oxopiperidin-1-yl)pyrimidine
- CBNumber
- CB8721350
- Molecular Formula
- C9H11N3O
- Formula Weight
- 177.2
- MOL File
- 116247-92-8.mol
1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE Property
- Melting point:
- 73-75°C
- Boiling point:
- 366.8±52.0 °C(Predicted)
- Density
- 1.225±0.06 g/cm3(Predicted)
- storage temp.
- 2-8°C, protect from light
- pka
- 4.65±0.33(Predicted)
- Appearance
- White to off-white Solid
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H317May cause an allergic skin reaction
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- P997380
- Product name
- 1-Pyrimidin-2-yl-piperidin-4-one
- Packaging
- 50mg
- Price
- $60
- Updated
- 2021/12/16
- Product number
- 044778
- Product name
- 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
- Purity
- >95%
- Packaging
- 5g
- Price
- $140
- Updated
- 2021/12/16
- Product number
- OR15509
- Product name
- 1-(Pyrimidin-2-yl)piperidin-4-one
- Packaging
- 5g
- Price
- $199
- Updated
- 2021/12/16
- Product number
- 044778
- Product name
- 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
- Purity
- >95%
- Packaging
- 500mg
- Price
- $26
- Updated
- 2021/12/16
- Product number
- 044778
- Product name
- 1-(2-Pyrimidinyl)tetrahydro-4(1H)-pyridinone
- Purity
- >95%
- Packaging
- 1g
- Price
- $40
- Updated
- 2021/12/16
1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE Chemical Properties,Usage,Production
Synthesis
1722-12-9
41979-39-9
116247-92-8
The general procedure for the synthesis of 1-(pyrimidin-2-yl)piperidin-4-one from 2-chloropyrimidine and 4-oxopiperidone hydrochloride is as follows: 5.1 Preparation of 1-(pyrimidin-2-yl)piperidin-4-one: A. A mixture of 4-piperidone monohydrate hydrochloride (4.84 g, 31.5 mmol), 2-chloropyrimidine (3.44 g, 30 mmol) and triethylamine (TEA, 10.04 mL, 72 mmol) was dissolved in ethanol (EtOH, 150 mL) and heated to reflux overnight. After completion of the reaction, the mixture was concentrated to near dryness and diluted with ethyl acetate (EtOAc, 400 mL). The EtOAc layer was washed sequentially with water (2 × 50 mL) and brine (2 × 50 mL). The aqueous layer was back-extracted with EtOAc (4 × 100 mL). All EtOAc layers were combined, dried with anhydrous sodium sulfate (Na2SO4), filtered and the solvent concentrated under reduced pressure. The residue was purified by ISCO fast chromatography (120 g silica gel column, elution procedure: hexane for 5 min, 0-80% EtOAc/hexane gradient for 70 min, and a final pure EtOAc elution for 15 min) to afford the target product 1-(pyrimidin-2-yl)piperidin-4-one (3.5 g, 66% yield). The product characterization data are shown below: HPLC analytical conditions: a Luna Phenyl-Hexyl 5 μm 4.6×50 mm column with 10 mM aqueous ammonium acetate as mobile phase A and acetonitrile as mobile phase B. Gradient elution (10-90% B, 3 min) was performed at a flow rate of 3 mL/min with retention times of 0.97 and 1.08 min. Mass spectrum (MS): m/z 178 [M+H]+. 1H NMR (300 MHz, CDCl3): δ 2.52 (t, J = 6.29 Hz, 4H), 4.15 (t, J = 6.20 Hz, 4H), 6.60 (t, J = 4.67 Hz, 1H), 8.38 (d, J = 4.77 Hz, 2H).
References
[1] Patent: WO2008/58064, 2008, A1. Location in patent: Page/Page column 17
[2] Patent: WO2008/58068, 2008, A1. Location in patent: Page/Page column 23
[3] Patent: WO2008/67120, 2008, A2. Location in patent: Page/Page column 23
[4] Patent: WO2008/67121, 2008, A2. Location in patent: Page/Page column 52
[5] Patent: US2006/258672, 2006, A1. Location in patent: Page/Page column 17
1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE manufacturers
- Product
- 1-PYRIMIDIN-2-YL-PIPERIDIN-4-ONE 116247-92-8
- Price
- US $1.10/g
- Min. Order
- 1g
- Purity
- 99.00%
- Supply Ability
- 100 Tons
- Release date
- 2022-02-16