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ChemicalBook > CAS DataBase List > (S)-(+)-1-Methyl-3-pyrrolidinol

(S)-(+)-1-Methyl-3-pyrrolidinol

Uses
Product Name
(S)-(+)-1-Methyl-3-pyrrolidinol
CAS No.
104641-59-0
Chemical Name
(S)-(+)-1-Methyl-3-pyrrolidinol
Synonyms
CAS:104641-59-0;CHEMPACIFIC 38130;Methyl-3-Pyrrolidinol;Glycopyrrolate Impurity 8;Glycopyrrolate Impurity 21;(S)-1-METHYLPYRROLIDIN-3-OL;(S)-N-Methyl-3-pyrrolidinol;(S)-1-METHYL-3-PYRROLIDINOL;(3S)-1-methylpyrrolidin-3-ol;(R)-3-Hydroxy-1-methylpyr...
CBNumber
CB6765260
Molecular Formula
C5H11NO
Formula Weight
101.15
MOL File
104641-59-0.mol
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(S)-(+)-1-Methyl-3-pyrrolidinol Property

Boiling point:
181-182 °C(lit.)
alpha 
6 º (c=1%, chloroform)
Density 
0.993 g/mL at 25 °C(lit.)
refractive index 
n20/D 1.4660(lit.)
Flash point:
192 °F
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
form 
Liquid
pka
14.95±0.20(Predicted)
color 
Colorless to yellow to brown
optical activity
[α]20/D +6°, c = 1 in chloroform
Sensitive 
Air Sensitive & Hygroscopic
BRN 
4349394
CAS DataBase Reference
104641-59-0(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36
RIDADR 
NA 1993 / PGIII
WGK Germany 
3
RTECS 
TM9570000
HS Code 
29339900
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H227Combustible liquid

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P403+P235Store in a well-ventilated place. Keep cool.

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N-Bromosuccinimide Price

TCI Chemical
Product number
M1938
Product name
(S)-1-Methyl-3-pyrrolidinol
Purity
>98.0%(GC)(T)
Packaging
1g
Price
$119
Updated
2025/07/31
TCI Chemical
Product number
M1938
Product name
(S)-1-Methyl-3-pyrrolidinol
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$356
Updated
2025/07/31
TRC
Product number
M329040
Product name
(S)-1-Methyl-3-pyrrolidinol
Packaging
1g
Price
$130
Updated
2021/12/16
TRC
Product number
M329040
Product name
(S)-1-Methyl-3-pyrrolidinol
Packaging
5g
Price
$495
Updated
2021/12/16
Oakwood
Product number
092713
Product name
(S)-(+)-1-Methyl-3-pyrrolidinol
Purity
95+%
Packaging
250mg
Price
$22
Updated
2021/12/16
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(S)-(+)-1-Methyl-3-pyrrolidinol Chemical Properties,Usage,Production

Uses

(S)-1-Methyl-3-pyrrolidinol is a useful synthetic intermediate. It is used to prepare diaryl acylaminopyrimidines as adenosine A2A antagonists. It is also used to synthesize (alkoxyamino)(pyridinylamino)pyrazinecarbonitriles as selective checkpoint kinase 1 (CHK1) inhibitors with oral antitumor activities.

Uses

(S)-1-Methyl-3-pyrrolidinol is a useful synthetic intermediate. It is used to prepare diaryl acylaminopyrimidines as adenosine A2A antagonists. It is also used to synthesize (alkoxyamino)(pyridinylamino)pyrazinecarbonitriles as selective checkpoint kinase 1 (CHK1) inhibitors with oral antitumor activities.

Synthesis

1104643-24-4

104641-59-0

The general procedure for synthesizing (S)-(+)-1-methyl-3-hydroxypyrrolidine from the compound (CAS:1104643-24-4) was as follows: 112 g of S-3-tert-butoxy-N-methylpyrrolidine was dissolved in 300 mL of dichloroethane. Subsequently, 117 g of concentrated hydrochloric acid (1.16 mol) was slowly added dropwise to the above solution and the dropwise process lasted for 1 hour. The reaction solution was stirred at 55-60°C for 2 hours. After completion of the reaction, the mixture was cooled to room temperature and diluted by adding 50 g of water. After separation of the organic layer, the aqueous layer was concentrated under reduced pressure. To the concentrated residue, 500 mL of isopropanol was added, followed by the slow addition of 46.83 g (1.16 mol) of sodium hydroxide, the addition process lasted for 1 hr, followed by stirring for 5 hr at room temperature. The solid phase inorganic material was removed by filtration and the filtrate was concentrated under reduced pressure to give a final 45.3 g of S-1-methyl-3-pyrrolidinol (total two-step yield of 58%, chemical purity of 99.36%, optical purity of 99.31% ee). The product was characterized by 1H NMR (CDCl3, 400 MHz): δ 1.73 (m, 1H), 2.20 (m, 2H), 2.34 (s, 3H), 2.47 (dd, J = 5.2,10 Hz, 1H), 2.64 (d, J = 10 Hz, 1H), 2.85 (m, 1H), 4.32 (m, 1H) ppm.

References

[1] Patent: WO2009/11551, 2009, A2. Location in patent: Page/Page column 15

(S)-(+)-1-Methyl-3-pyrrolidinol Preparation Products And Raw materials

Raw materials

Preparation Products

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(S)-(+)-1-Methyl-3-pyrrolidinol Suppliers

J & K SCIENTIFIC LTD.
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18210857532; 18210857532
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86-10-82849933
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jkinfo@jkchemical.com
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China
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Meryer (Shanghai) Chemical Technology Co., Ltd.
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TCI (Shanghai) Development Co., Ltd.
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Energy Chemical
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Shanghai Longsheng chemical Co.,Ltd.
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021-58099652-8005 13585536065
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021-58099609
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Nanjing Chemlin Chemical Co., Ltd
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025-83697070
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+86-25-83453306
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021-54306202 13764082696
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View Lastest Price from (S)-(+)-1-Methyl-3-pyrrolidinol manufacturers

Zhuozhou Wenxi import and Export Co., Ltd
Product
(S)-(+)-1-Methyl-3-pyrrolidinol 104641-59-0
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-06-27
Career Henan Chemical Co
Product
(S)-(+)-1-Methyl-3-pyrrolidinol 104641-59-0
Price
US $1.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
1kg,5kg,100kg
Release date
2019-07-04

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