N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol
- CAS No.
- 101469-92-5
- Chemical Name:
- N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol
- Synonyms
- tert-butyl (S)-3-hydroxypyrrolidine-1-carboxylate;(S)-TERT-BUTYL 3-HYDROXYPYRROLIDINE-1-CARBOXYLATE;(S)-1-BOC-3-HYDROXYPYRROLIDINE;(S)-N-BOC-3-PYRROLIDINOL;(S)-1-N-Boc-3-pyrrolidinol;(S)-N-BOC-3-HYDROXYPYRROLIDINE;(S)-1-Boc-3;Evocalcet impurity 35;(S)-1-BOC-3-Pyrolidinol;Cilnidipine Impurity 62
- CBNumber:
- CB4232377
- Molecular Formula:
- C9H17NO3
- Molecular Weight:
- 187.24
- MDL Number:
- MFCD01317839
- MOL File:
- 101469-92-5.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 60-64 °C (lit.) |
|---|---|
| alpha | 26 º (c=1%, MeOH) |
| Boiling point | 273.3±33.0 °C(Predicted) |
| Density | 1.142±0.06 g/cm3(Predicted) |
| refractive index | 27 ° (C=1, MeOH) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| pka | 14.74±0.20(Predicted) |
| form | Crystalline Powder |
| color | White to pale yellow |
| optical activity | [α]20/D +26°, c = 1% in methanol |
| BRN | 6271108 |
| InChI | InChI=1S/C9H17NO3/c1-9(2,3)13-8(12)10-5-4-7(11)6-10/h7,11H,4-6H2,1-3H3/t7-/m0/s1 |
| InChIKey | APCBTRDHCDOPNY-ZETCQYMHSA-N |
| SMILES | N1(C(OC(C)(C)C)=O)CC[C@H](O)C1 |
| CAS DataBase Reference | 101469-92-5(CAS DataBase Reference) |
| UNSPSC Code | 12352005 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) | ![]() ![]() GHS05,GHS06 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H301-H315-H318-H335 | |||||||||
| Precautionary statements | P280-P301+P310+P330-P302+P352-P305+P351+P338+P310 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges | |||||||||
| Hazard Codes | T,Xi | |||||||||
| Risk Statements | 25-37/38-41-R41-R37/38-R25 | |||||||||
| Safety Statements | 26-39-45-S45-S39-S26 | |||||||||
| RIDADR | UN 2811 6.1/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| F | 10 | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | Ⅲ | |||||||||
| HS Code | 29339900 | |||||||||
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
|||||||||
| Hazard Classifications | Acute Tox. 3 Oral Eye Dam. 1 Skin Irrit. 2 STOT SE 3 |
|||||||||
| NFPA 704 |
|
N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol price More Price(73)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | 634786 | (S)-(+)-N-Boc-3-pyrrolidinol 97% | 101469-92-5 | 1g | $59.4 | 2026-04-30 | Buy |
| Sigma-Aldrich | 634786 | (S)-(+)-N-Boc-3-pyrrolidinol 97% | 101469-92-5 | 5g | $137 | 2026-04-30 | Buy |
| TCI Chemical | B3055 | (S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol >98.0%(GC) | 101469-92-5 | 1g | $25 | 2026-04-30 | Buy |
| TCI Chemical | B3055 | (S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol >98.0%(GC) | 101469-92-5 | 5g | $37 | 2026-04-30 | Buy |
| Usbiological | 264239 | S-N-Boc-3-hydroxypyrrolidine Asreported | 101469-92-5 | 10g | $365 | 2026-06-03 | Buy |
N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol Chemical Properties,Uses,Production
Chemical Properties
white to light yellow crystal powde
Uses
(S)-(+)-N-Boc-3-pyrrolidinol can be used as a reactant to synthesize:
- tert-Butyl 3-(2-bromophenoxy)pyrrolidine-1-carboxylate, which is employed as a key intermediate in the preparation of IkB-kinase IKK2 inhibitor.
- Dimethoxy-pyrrolidylquinazoline , and peptidomimetic quinoline derivatives.
Synthesis
24424-99-5
40499-83-0
83220-73-9
The general procedure for the synthesis of 1-tert-butoxycarbonyl-3-hydroxy-pyrrolidine from di-tert-butyl dicarbonate and 3-hydroxy-pyrrolidine was as follows: first, (R)-3-pyrrolidinol (539 mg, 6.19 mmol) was converted into compound 16b to afford a colorless oily substance (1.3 g, 100% yield). The spectral data of this product were consistent with the expected structure and in accordance with literature reports (see Kucznierz, R. et al. J. Med. Chem. 1998, 41, 4983-4994). Subsequently, compound 16b was converted by reaction to compound 16c, again as a colorless oil. Next, compound 16e was prepared from compound 16c by a two-step reaction, still as a colorless oily substance. Finally, compound 16e was further reacted to obtain the target product compound 16, which was rendered as a yellow oily substance.
References
[1] ACS Medicinal Chemistry Letters, 2013, vol. 4, # 10, p. 969 - 973
[2] Patent: WO2015/9731, 2015, A2. Location in patent: Paragraph 00106
[3] Journal of Medicinal Chemistry, 1998, vol. 41, # 25, p. 4983 - 4994
[4] Bioorganic and Medicinal Chemistry, 2006, vol. 14, # 17, p. 5812 - 5832
[5] Patent: WO2010/84767, 2010, A1. Location in patent: Page/Page column 86
N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol Preparation Products And Raw materials
Raw materials
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Preparation Products
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| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Wuxi Hailun Bio-Technology Co., Ltd. | 0510-85629785 18051595327; | sales@hlsw-bio.com | China | 101 | 58 |
| Sichuan Argalbio Technology Co,.Ltd | 028-028-60651388 13980413900 | slyu@hengkangtech.com | China | 575 | 58 |
| Chengdu Firster Pharmaceutical Co., Ltd. | 028-87078428 028-87074958 | chengzhenyong@cdfirster.com | China | 2580 | 60 |
| BTC Pharmaceutical CO. Ltd | +86-15716293042 15716293042 | info@btcpharm.com | China | 823 | 55 |
| Tianjin Propharm Co., Ltd. | 185-11025967 18511025967 | wubin@propharm.cn | China | 60 | 58 |
| Nanjing Huarui Biopharmaceutical Technology Co., Ltd. | 18014824111 | 1623163500@qq.com | China | 336 | 58 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| Meryer (Shanghai) Chemical Technology Co., Ltd. | 4006356688 18621169109 | market03@meryer.com | China | 40202 | 62 |
| 3B Pharmachem (Wuhan) International Co.,Ltd. | 18930552037 | 3bsc@sina.com | China | 15813 | 69 |
| Alfa Aesar | 400-6106006 | saleschina@alfa-asia.com | China | 30103 | 84 |
View Lastest Price from N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
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2026-08-08 | (S)-1-N-Boc-3-pyrrolidinol
101469-92-5
|
1kg | 99.0% | 20 tons | Hangzhou ICH Biofarm Co., Ltd | ||
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2026-07-30 | N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol
101469-92-5
|
$180.00-200.00 | 1KG | less more than 98% | 20tons | Anhui Dexinjia Biopharm Co., Ltd | |
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2025-12-16 | Evocalcet Impurity 10
101469-92-5
|
10mg | 95%+ | 10000 | Moxin Chemicals |
-

- (S)-1-N-Boc-3-pyrrolidinol
101469-92-5
- 99.0%
- Hangzhou ICH Biofarm Co., Ltd
-

- N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol
101469-92-5
- $180.00-200.00
- less more than 98%
- Anhui Dexinjia Biopharm Co., Ltd
-

- Evocalcet Impurity 10
101469-92-5
- 95%+
- Moxin Chemicals
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