ChemicalBook > CAS DataBase List > METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE
METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE
- Product Name
- METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE
- CAS No.
- 17012-21-4
- Chemical Name
- METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE
- Synonyms
- Methyl 1-benzyllpyrrolidi...;Methyl 1-benzyl-3-pyrrolidinecarboxylate;METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE;METHYL 1-BENZYLPYRROLIDINE-3-CARBOXYLATE;Methyl 1-benzyllpyrrolidine-3-carboxylate;MethylN-benzylpyrrolidine-3-carboxylate,97%;Methyl 1-benzylpyrrolidine-3-carboxylate 97%;Methyl N-benzylpyrrolidine-3-carboxylate, 97%;Methyl 1-(phenylmethyl)-3-pyrrolidinecarboxylate;N-benzyl-pyrrolidine-3-carboxylicacidmethylester
- CBNumber
- CB1183304
- Molecular Formula
- C13H17NO2
- Formula Weight
- 219.28
- MOL File
- 17012-21-4.mol
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METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE Property
- Boiling point:
- 98℃/0.2mm
- Density
- 1.08
- refractive index
- 1.5211
- storage temp.
- 2-8°C
- form
- clear liquid
- pka
- 8.34±0.40(Predicted)
- color
- Colorless to Light orange to Yellow
- Water Solubility
- Sparingly soluble in water.(0.26 g/L) (25°C),
- InChI
- InChI=1S/C13H17NO2/c1-16-13(15)12-7-8-14(10-12)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
- InChIKey
- GDWFCUOFVSNTTG-UHFFFAOYSA-N
- SMILES
- N1(CC2=CC=CC=C2)CCC(C(OC)=O)C1
- CAS DataBase Reference
- 17012-21-4
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Safety
- HS Code
- 2933998090
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Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H319Causes serious eye irritation
- Precautionary statements
-
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
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N-Bromosuccinimide Price
TCI Chemical
- Product number
- M2866
- Product name
- Methyl 1-Benzylpyrrolidine-3-carboxylate
- Purity
- >98.0%(GC)(T)
- Packaging
- 1g
- Price
- $70
- Updated
- 2025/07/31
TCI Chemical
- Product number
- M2866
- Product name
- Methyl 1-Benzylpyrrolidine-3-carboxylate
- Purity
- >98.0%(GC)(T)
- Packaging
- 5g
- Price
- $207
- Updated
- 2025/07/31
TRC
- Product number
- B486058
- Product name
- Methyl 1-Benzylpyrrolidine-3-carboxylate
- Packaging
- 10mg
- Price
- $45
- Updated
- 2021/12/16
Matrix Scientific
- Product number
- 069019
- Product name
- Methyl 1-benzyllpyrrolidine-3-carboxylate
- Purity
- >95%
- Packaging
- 1g
- Price
- $60
- Updated
- 2021/12/16
Apolloscientific
- Product number
- OR52084
- Product name
- Methyl 1-Benzylpyrrolidine-3-carboxylate
- Purity
- 98%
- Packaging
- 1g
- Price
- $66
- Updated
- 2021/12/16
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METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE Chemical Properties,Usage,Production
Uses
It is used as pharmaceutical intermediate. Benzoylthiophenes are allosteric enhancers (AE) of agonist activity at the A1 adenosine receptor.
Synthesis Reference(s)
The Journal of Organic Chemistry, 33, p. 3637, 1968 DOI: 10.1021/jo01273a063
Synthesis
93102-05-7
292638-85-8
17012-21-4
A trifluoroacetic acid solution of 44.0 g (0.4 mol) at a mass concentration of 10% was prepared by adding 1530.0 g (6.5 mol) of N-(methoxymethyl)-N-(trimethylsilylmethyl)benzylamine, 31.80 g (3.7 mol) of methyl acrylate, and 38 mL of dichloromethane to a 250 mL multi-neck reaction flask. The trifluoroacetic acid solution was added slowly dropwise at 0 °C, and after completion of the dropwise addition, the reaction mixture was stirred at room temperature overnight. Upon completion of the reaction, the mixture was concentrated under reduced pressure and the residue was washed sequentially with saturated sodium bicarbonate solution and saturated sodium chloride solution. The organic phases were combined, dried with anhydrous sodium sulfate, filtered, and the filtrate was concentrated under reduced pressure to give 1420.0 g of 1-benzylpyrrolidine-3-carboxylic acid methyl ester crude product in 100% yield.
References
[1] Bioorganic and Medicinal Chemistry Letters, 2004, vol. 14, # 19, p. 4861 - 4866
[2] Organic Process Research and Development, 2009, vol. 13, # 2, p. 292 - 296
[3] Synthesis, 2006, # 16, p. 2646 - 2648
[4] Synlett, 2015, vol. 26, # 13, p. 1815 - 1818
[5] Chemical & Pharmaceutical Bulletin, 1985, vol. 33, # 7, p. 2762 - 2766
METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE manufacturers
Career Henan Chemical Co
- Product
- METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATE 17012-21-4
- Price
- US $8.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 10tons
- Release date
- 2018-12-25
17012-21-4, METHYL N-BENZYL-3-PYRROLIDINECARBOXYLATERelated Search:
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