4-(MORPHOLINOMETHYL)BENZOIC ACID
- Product Name
- 4-(MORPHOLINOMETHYL)BENZOIC ACID
- CAS No.
- 62642-62-0
- Chemical Name
- 4-(MORPHOLINOMETHYL)BENZOIC ACID
- Synonyms
- AKOS BB-9472;BUTTPARK 98\57-92;TIMTEC-BB SBB011465;4-(MORPHOLINOMETHYL)BENZOIC ACID;4-MORPHOLIN-4-YLMETHYLBENZOIC ACID;4-(4-Morpholinemethyl)benzoic acid;4-(4-Morpholinylmethyl)benzoic acid;Benzoic acid, 4-(4-morpholinylmethyl)-;4-MORPHOLIN-4-YLMETHYLBENZOIC ACID 95%;4-(4-Morpholinylmethyl)benzoic acid, 97%
- CBNumber
- CB0747079
- Molecular Formula
- C12H15NO3
- Formula Weight
- 221.25
- MOL File
- 62642-62-0.mol
4-(MORPHOLINOMETHYL)BENZOIC ACID Property
- Melting point:
- 179-183°C
- Boiling point:
- 369.8±32.0 °C(Predicted)
- Density
- 1.233±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 4.00±0.10(Predicted)
- color
- Off-White to Beige
- Sensitive
- Hygroscopic
- CAS DataBase Reference
- 62642-62-0
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
- M725180
- Product name
- 4-(Morpholinomethyl)benzoicAcid
- Packaging
- 5g
- Price
- $100
- Updated
- 2021/12/16
- Product number
- W7468
- Product name
- 4-Morpholin-4-ylmethylbenzoicacid
- Packaging
- 1g
- Price
- $103
- Updated
- 2021/12/16
- Product number
- 032779
- Product name
- 4-Morpholin-4-ylmethyl-benzoic acid
- Packaging
- 500mg
- Price
- $200
- Updated
- 2021/12/16
- Product number
- COR0002969
- Product name
- 4-MORPHOLIN-4-YLMETHYLBENZOIC ACID
- Purity
- 95.00%
- Packaging
- 250MG
- Price
- $133.61
- Updated
- 2021/12/16
- Product number
- 4H58-1-023
- Product name
- 4-Morpholin-4-ylmethylbenzoic acid
- Packaging
- 1g
- Price
- $152
- Updated
- 2021/12/16
4-(MORPHOLINOMETHYL)BENZOIC ACID Chemical Properties,Usage,Production
Uses
4-?(Morpholinomethyl)?benzoic Acid is a reactant used in the synthesis of sirtuin 2 inhibitors, used in the treatment of parkinsons.
Synthesis
68453-56-5
62642-62-0
General procedure for the synthesis of 4-morpholinomethylbenzoic acid from methyl 4-(morpholinomethyl)benzoate: to a stirred solution of methyl 4-(morpholinomethyl)benzoate (4.0 g, 17.0020 mmol, 1.0 eq.) in methanol (40 mL) was added slowly at 0 °C an aqueous 1N NaOH solution (136.0 mL, 136.0 mmol, 8.0 equivalent). The reaction mixture was stirred at room temperature overnight. The progress of the reaction was monitored by TLC and after confirming the completion of the reaction, the reaction mixture was cooled to 0 °C and neutralized with 1N HCl to pH neutral. Subsequently, the solvent was removed by evaporation under reduced pressure. Methanol (40 mL) and dichloromethane (60 mL) were added to the resulting solid and stirred at room temperature for 25 minutes. The mixture was filtered and the filtrate was evaporated under reduced pressure to recover the product. The above extraction and evaporation process was repeated twice to finally obtain a white solid product (3.0 g, yield: 79.57%), which could be used in the next reaction without further purification. The structure of the product was confirmed by 1H NMR (300 MHz, CDCl3) and ESI-MS: 1H NMR δ 8.04 (d, J = 8.1 Hz, 2H), 7.50 (d, J = 8.1 Hz, 2H), 3.81 (m, 4H), 3.71 (s, 2H), 2.62 (m, 4H); ESI-MS: m/z 222.01 (M + H)+.
References
[1] Patent: WO2018/29604, 2018, A1. Location in patent: Page/Page column 45
[2] Bioorganic and Medicinal Chemistry, 2016, vol. 24, # 2, p. 179 - 190
4-(MORPHOLINOMETHYL)BENZOIC ACID Preparation Products And Raw materials
Raw materials
Preparation Products
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