N-Phenyl-isobutyloylacetamide
- Product Name
- N-Phenyl-isobutyloylacetamide
- CAS No.
- 124401-38-3
- Chemical Name
- N-Phenyl-isobutyloylacetamide
- Synonyms
- Isobutyrylacetanilide;2-Isobutyrylacetanilide;Atorvastatin Impurity 66;Atorvastatin Impurity 197;N-PHENYL ISOBUTYRYLACETAMIDE;N-PHENYL-ISOBUTYLOYLACETAMIDE;N-PhNeyl-isobutyloyl Acetamide;Atorvastatin calcium impurity 65;N-Phenyl-4-Methyl-3-oxopentanaMide;4-methyl-3-oxo-n-phenyl-pentanamide
- CBNumber
- CB4233839
- Molecular Formula
- C12H15NO2
- Formula Weight
- 205.25
- MOL File
- 124401-38-3.mol
N-Phenyl-isobutyloylacetamide Property
- Melting point:
- 47 - 49°C
- Boiling point:
- 261-264 °C
- Density
- 1.103
- Flash point:
- 159°C
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Metahnol (Slightly)
- pka
- 12.14±0.46(Predicted)
- form
- Solid
- color
- Off-White to Pale Pink
- InChI
- InChI=1S/C12H15NO2/c1-9(2)11(14)8-12(15)13-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,13,15)
- InChIKey
- ADHRFDCBLJVNFO-UHFFFAOYSA-N
- SMILES
- C(NC1=CC=CC=C1)(=O)CC(=O)C(C)C
- CAS DataBase Reference
- 124401-38-3(CAS DataBase Reference)
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.
P271Use only outdoors or in a well-ventilated area.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352IF ON SKIN: wash with plenty of soap and water.
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.
P312Call a POISON CENTER or doctor/physician if you feel unwell.
P403+P233Store in a well-ventilated place. Keep container tightly closed.
N-Bromosuccinimide Price
- Product number
- P335325
- Product name
- N-PhenylIsobutyrylacetamide
- Packaging
- 1g
- Price
- $65
- Updated
- 2021/12/16
- Product number
- P335325
- Product name
- N-PhenylIsobutyrylacetamide
- Packaging
- 2g
- Price
- $90
- Updated
- 2021/12/16
- Product number
- 286793
- Product name
- N-Phenyl isobutyrylacetamide
- Packaging
- 100mg
- Price
- $406
- Updated
- 2021/12/16
- Product number
- J94071
- Product name
- 4-Methyl-3-oxo-N-phenyl-pentanamide
- Packaging
- 1g
- Price
- $19
- Updated
- 2021/12/16
- Product number
- CHM0014770
- Product name
- N-PHENYL ISOBUTYRYLACETAMIDE
- Purity
- 95.00%
- Packaging
- 10G
- Price
- $1166.55
- Updated
- 2021/12/16
N-Phenyl-isobutyloylacetamide Chemical Properties,Usage,Production
Chemical Properties
Yellow Oil
Uses
N-Phenyl Isobutyrylacetamide (cas# 124401-38-3) is a compound useful in organic synthesis.
Synthesis
42558-54-3
62-53-3
124401-38-3
To a 1000 mL dry three-necked flask were sequentially added 60 g (0.416 mol) of methyl isobutyrylacetate, 120 g (1.288 mol) of aniline and 6 g of 4-dimethylaminopyridine (DMAP). Stirring was turned on and the temperature was slowly increased to an internal temperature of 100 °C and the reaction was maintained at this temperature for 16 hours. During the reaction, the methanol generated was collected by a fractionation device. At the end of the reaction, the system was cooled down to 70 °C and the unreacted aniline was recovered by distillation under reduced pressure, and a total of 74.7 g of aniline was recovered with 92% recovery. After the remaining reaction solution was concentrated to about 100 g, 1 kg of water was added, cooled to 30 °C and stirred to crystallize for more than 5 hours. The product was filtered, the cake was washed with water for 3 times, and dried to give a white solid product of 82.3 g. The product was analyzed by HPLC with a purity of 99.8% and a yield of 96.4%.
References
[1] Patent: CN106397241, 2017, A. Location in patent: Paragraph 0014; 0015; 0016; 0017; 0018; 0019; 0020; 0021
[2] Patent: WO2012/143933, 2012, A1. Location in patent: Page/Page column 21-22
[3] Organic and Biomolecular Chemistry, 2016, vol. 14, # 7, p. 2291 - 2296
[4] Synthetic Communications, 2015, vol. 45, # 24, p. 2832 - 2840
[5] Journal of Heterocyclic Chemistry, 2007, vol. 44, # 4, p. 923 - 926
N-Phenyl-isobutyloylacetamide Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from N-Phenyl-isobutyloylacetamide manufacturers
- Product
- 4-methyl-3-oxo-N-phenyl pentanamide 124401-38-3
- Price
- US $0.00-0.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 500
- Release date
- 2023-06-27
- Product
- N-Phenyl-isobutyloylacetamide 124401-38-3
- Price
- US $1.00/kg
- Min. Order
- 1kg
- Purity
- 98%
- Supply Ability
- 100KG
- Release date
- 2018-12-22