tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate
- Product Name
- tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate
- CAS No.
- 581060-27-7
- Chemical Name
- tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate
- Synonyms
- 1-Boc-4-(Mercaptomethyl);1-Boc-4-(MercaptoMethyl)piperidine;tert-butyl 4-(sulfanylmethyl)piperidine-1-carboxylate;tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate;4-Mercaptomethyl-piperidine-1-carboxylic acid tert-butyl ester;4-(Mercaptomethyl)-1-piperidinecarboxylic acid tert-butyl ester;1-Piperidinecarboxylic acid, 4-(mercaptomethyl)-, 1,1-dimethylethyl ester
- CBNumber
- CB42534222
- Molecular Formula
- C11H21NO2S
- Formula Weight
- 231.35
- MOL File
- 581060-27-7.mol
tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate Property
- Boiling point:
- 316.9±15.0 °C(Predicted)
- Density
- 1.052
- storage temp.
- Inert atmosphere,Store in freezer, under -20°C
- pka
- 10.23±0.10(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C11H21NO2S/c1-11(2,3)14-10(13)12-6-4-9(8-15)5-7-12/h9,15H,4-8H2,1-3H3
- InChIKey
- VEPAXJUGIFPJNK-UHFFFAOYSA-N
- SMILES
- N1(C(OC(C)(C)C)=O)CCC(CS)CC1
N-Bromosuccinimide Price
- Product number
- Z2886
- Product name
- 4-Mercaptomethylpiperidine-1-carboxylicacidtert-butylester
- Packaging
- 250mg
- Price
- $604
- Updated
- 2021/12/16
- Product number
- 34306
- Product name
- tert-butyl4-(mercaptomethyl)piperidine-1-carboxylate
- Purity
- 95%
- Packaging
- 1g
- Price
- $920
- Updated
- 2021/12/16
- Product number
- Z2886
- Product name
- 4-Mercaptomethylpiperidine-1-carboxylicacidtert-butylester
- Packaging
- 500mg
- Price
- $951
- Updated
- 2021/12/16
- Product number
- CD11100425
- Product name
- 1-Boc-4-(Mercaptomethyl)piperidine
- Purity
- 97%
- Packaging
- 1g
- Price
- $820
- Updated
- 2021/12/16
- Product number
- AR00EJNY
- Product name
- tert-butyl4-(mercaptomethyl)piperidine-1-carboxylate
- Purity
- 97%
- Packaging
- 50mg
- Price
- $111
- Updated
- 2021/12/16
tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate Chemical Properties,Usage,Production
Synthesis
895126-44-0
581060-27-7
A reaction was carried out with tert-butyl 4-((carbamoylimidothio)methyl)piperidine-1-carboxylate (1.2, 15 g, 1.00 eq., crude) as raw material with sodium hydroxide (2.2 g, 55.00 mmol, 1.00 eq.) in a mixture of methanol/water (1:2 v/v, 150 mL) under argon protection at 60 °C with stirring for 2 hours. After completion of the reaction, the reaction mixture was cooled to room temperature. The pH of the reaction solution was adjusted with 35% aqueous hydrochloric acid to 7. The reaction solution was extracted with ethyl acetate (3 x 50 mL) and the organic phases were combined. The organic phase was washed with saturated saline (2 x 50 mL), dried over anhydrous sodium sulfate, filtered and concentrated under reduced pressure. The resulting residue was purified by silica gel column chromatography (eluent: ethyl acetate/petroleum ether=1:8 v/v) to give 5.6 g of yellow oily product in 44% yield. The structure of the product was confirmed by 1H-NMR (400 MHz, CDCl3): δ 4.13 (m, 2H), 2.69 (m, 2H), 2.46 (m, 2H), 1.82 (m, 2H), 1.50 (s, 9H), 1.32 (m, 1H), 1.18 (m, 2H) ppm.
References
[1] Patent: US2016/243100, 2016, A1. Location in patent: Paragraph 0078
tert-butyl 4-(mercaptomethyl)piperidine-1-carboxylate Preparation Products And Raw materials
Raw materials
Preparation Products
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