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N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol

Product Name
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)-1-BOC-3-HYDROXYPYRROLIDINE;(S)-TERT-BUTYL 3-HYDROXYPYRROLIDINE-1-CARBOXYLATE;(S)-N-BOC-3-PYRROLIDINOL;(S)-1-N-Boc-3-pyrrolidinol;(S)-N-BOC-3-HYDROXYPYRROLIDINE;(S)-1-Boc-3;(S)-1-BOC-3-Pyrolidinol;Cilnidipine Impurity 62;(S)-1-BOC-3-PYRROLIDINOL
CBNumber
CB4232377
Molecular Formula
C9H17NO3
Formula Weight
187.24
MOL File
101469-92-5.mol
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N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol Property

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)
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Safety

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
10
HazardClass 
6.1
PackingGroup 
HS Code 
29339900
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

H315Causes skin irritation

H318Causes serious eye damage

H335May cause respiratory irritation

Precautionary statements

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
634786
Product name
(S)-(+)-N-Boc-3-pyrrolidinol
Purity
97%
Packaging
1g
Price
$27.9
Updated
2025/07/31
Sigma-Aldrich
Product number
634786
Product name
(S)-(+)-N-Boc-3-pyrrolidinol
Purity
97%
Packaging
5g
Price
$90.3
Updated
2025/07/31
TCI Chemical
Product number
B3055
Product name
(S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol
Purity
>98.0%(GC)
Packaging
1g
Price
$31
Updated
2025/07/31
TCI Chemical
Product number
B3055
Product name
(S)-1-(tert-Butoxycarbonyl)-3-pyrrolidinol
Purity
>98.0%(GC)
Packaging
5g
Price
$46
Updated
2025/07/31
TRC
Product number
B809915
Product name
(S)-tert-Butyl3-hydroxypyrrolidine-1-carboxylate
Packaging
1g
Price
$75
Updated
2021/12/16
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N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol Chemical Properties,Usage,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

Preparation Products

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N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol Suppliers

Wuxi Hailun Bio-Technology Co., Ltd.
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0510-85629785 18051595327
Fax
0510-85625359
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sales@hlsw-bio.com
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China
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Sichuan Argalbio Technology Co,.Ltd
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028-028-60651388 13330964498
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slyu@hengkangtech.com
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China
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185-11025967 18511025967
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J & K SCIENTIFIC LTD.
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86-10-82849933
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Meryer (Shanghai) Chemical Technology Co., Ltd.
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4006356688 18621169109
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86-21-61259102
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3B Pharmachem (Wuhan) International Co.,Ltd.
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821-50328103-801 18930552037
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86-21-50328109
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3bsc@sina.com
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Alfa Aesar
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400-6106006
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021-67582001/03/05
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saleschina@alfa-asia.com
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View Lastest Price from N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol manufacturers

Hebei Zhuanglai Chemical Trading Co Ltd
Product
Boc-3-Hydroxypyrrolidine 101469-92-5
Price
US $150.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
500kg
Release date
2024-11-22
Moxin Chemicals
Product
Evocalcet Impurity 10 101469-92-5
Price
US $0.00-0.00/mg
Min. Order
10mg
Purity
95%+
Supply Ability
10000
Release date
2025-01-22
Henan Aochuang Chemical Co.,Ltd.
Product
N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinol 101469-92-5
Price
US $0.00-0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
1Ton
Release date
2022-10-17

101469-92-5, N-(tert-Butoxycarbonyl)-(S)-(+)-3-pyrrolidinolRelated Search:


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