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(S)-1-Boc-3-methylpiperazine

Product Name
(S)-1-Boc-3-methylpiperazine
CAS No.
147081-29-6
Chemical Name
(S)-1-Boc-3-methylpiperazine
Synonyms
tert-butyl (S)-3-methylpiperazine-1-carboxylate;(S)-1-BOC-3-METHYLPIPERAZINE;(S)-TERT-BUTYL 3-METHYLPIPERAZINE-1-CARBOXYLATE;(S)-4-Boc-2-methylpiperazine;4-HYDROXY-7-METHOXYQUINOLINE-2-CARBOXYLIC ACID;4-Hydroxy-7-methoxy-2-quinolinecarboxylic acid;CPD2809-SM;(3S)-3-MethyL;(S)-4-N-BOC-2-METHYL;Sotorasib Impurity 2
CBNumber
CB9458934
Molecular Formula
C10H20N2O2
Formula Weight
200.28
MOL File
147081-29-6.mol
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(S)-1-Boc-3-methylpiperazine Property

Melting point:
40-45 °C
Boiling point:
268.7±15.0 °C(Predicted)
alpha 
-16 º (c=1 in dioxane)
Density 
0.997±0.06 g/cm3(Predicted)
storage temp. 
Keep in dark place,Inert atmosphere,2-8°C
pka
8.52±0.40(Predicted)
form 
Crystalline Powder
color 
White to yellow
optical activity
[α]/D -16±2°, c = 1 in dioxane
Sensitive 
Air Sensitive
InChI
InChI=1S/C10H20N2O2/c1-8-7-12(6-5-11-8)9(13)14-10(2,3)4/h8,11H,5-7H2,1-4H3/t8-/m0/s1
InChIKey
FMLPQHJYUZTHQS-QMMMGPOBSA-N
SMILES
N1(C(OC(C)(C)C)=O)CCN[C@@H](C)C1
CAS DataBase Reference
147081-29-6(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi
Risk Statements 
37/38-41-34
Safety Statements 
26-39-45-36/37/39
RIDADR 
3259
WGK Germany 
3
10-34
HS Code 
29335990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

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
63207
Product name
(S)-1-Boc-3-methylpiperazine
Purity
≥98%
Packaging
1g
Price
$37.6
Updated
2025/07/31
Sigma-Aldrich
Product number
63207
Product name
(S)-1-Boc-3-methylpiperazine
Purity
≥98%
Packaging
5G
Price
$78.4
Updated
2025/07/31
TCI Chemical
Product number
D6010
Product name
(S)-1-Boc-3-methylpiperazine
Purity
min. 98.0 %
Packaging
5G
Price
$47
Updated
2025/07/31
TCI Chemical
Product number
D6010
Product name
(S)-1-Boc-3-methylpiperazine
Purity
min. 98.0 %
Packaging
25G
Price
$142
Updated
2025/07/31
TRC
Product number
B656830
Product name
(S)-4-Boc-2-methylpiperazine
Packaging
25g
Price
$305
Updated
2021/12/16
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(S)-1-Boc-3-methylpiperazine Chemical Properties,Usage,Production

Description

(S)-1-Boc-3-methylpiperazine is a hydrophobic compound that is structurally modified from the tetracyclic family of drugs. It has been shown to inhibit tumor cell growth by binding to the oncogene, KRASG12C, and downregulating its expression. This compound also inhibits cancer cell growth through the inhibition of the PI3K/AKT signaling pathway. The pharmacological effects of (S)-1-Boc-3-methylpiperazine are dependent on its ability to bind with high affinity to KRASG12C and inhibit its activity.

Chemical Properties

colorless to yellow liquid

Uses

Laboratory chemicals, Manufacture of substances.

Uses

Reactant involved in the synthesis of biologically activy molecules including:

  • CCR5 antagonists with anti-HIV-1 activity
  • Opioid receptor antagonists
  • Human growth hormone secretagogue receptor antagonists for treatment of obesity
  • Fatty acid oxidation inhibitors

Uses

(S)-4-Boc-2-methylpiperazine ((S)-1-Boc-3-methylpiperazine) is a reagent used in the synthesis of benzamide peptidomimetic as non-ATP competitive inihbitors.

Synthesis

24424-99-5

74879-18-8

147081-29-6

At 0 °C, (S)-2-methylpiperazine (400 mg) was dissolved in dichloromethane (20 mL) and di-tert-butyl dicarbonate (871 mg) was slowly added. The reaction mixture was stirred at room temperature for 4 hours. Upon completion of the reaction, the reaction was quenched with deionized water (20 mL) followed by extraction with dichloromethane (2 x 40 mL). The organic phases were combined, washed with saturated sodium chloride solution (40 mL), dried over anhydrous magnesium sulfate, and concentrated under reduced pressure to afford (S)-4-N-tert-butoxycarbonyl-2-methylpiperazine as a white solid (669 mg, 84% yield).

References

[1] Organic Process Research and Development, 2018, vol. 22, # 8, p. 978 - 990
[2] Patent: US2008/76758, 2008, A1. Location in patent: Page/Page column 88
[3] Patent: WO2008/70740, 2008, A1. Location in patent: Page/Page column 184
[4] Patent: US2005/261310, 2005, A1. Location in patent: Page/Page column 19
[5] Patent: WO2018/109050, 2018, A1. Location in patent: Paragraph 0226-0230; 0234-0236; 0240-0241

(S)-1-Boc-3-methylpiperazine Preparation Products And Raw materials

Raw materials

Preparation Products

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(S)-1-Boc-3-methylpiperazine Suppliers

Chengdu Zhongde Jihua Pharmaceutical Technology Co., Ltd
Tel
15928014948; 15928014948
Email
3438599507@qq.com
Country
China
ProdList
97
Advantage
58
Chengdu Firster Pharmaceutical Co., Ltd.
Tel
028-87078428 028-87074958
Fax
8772-8116
Email
chengzhenyong@cdfirster.com
Country
China
ProdList
2598
Advantage
60
Shanghai Synteam Biochem CO.,ltd
Tel
+86-021-58380978 13482386415
Fax
021-58380978
Email
info@systeambc.com
Country
China
ProdList
896
Advantage
50
AstaTech(Chengdu) Biopharmaceutical Corp.
Tel
028-82666846 18080826311
Fax
QQ 2917178106
Email
sales@astatech.com.cn
Country
China
ProdList
499
Advantage
58
Purest Pharmaceuticl (Xi’an) Co,.LTD
Tel
13893405577
Email
12829054@qq.com
Country
China
ProdList
83
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58
SICHUAN TONGSHENG BIOPHARMACEUTICAL CO., LTD
Tel
0838-2809458 13350585791
Email
pharm@biots.cn
Country
China
ProdList
589
Advantage
58
Shanghai Fengluan Biotechnology Co., LTD
Tel
13357659136
Email
jing.z@fengluanbiotech.com
Country
China
ProdList
500
Advantage
58
J & K SCIENTIFIC LTD.
Tel
18210857532; 18210857532
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
ProdList
94644
Advantage
76
Meryer (Shanghai) Chemical Technology Co., Ltd.
Tel
4006356688 18621169109
Fax
86-21-61259102
Email
market03@meryer.com
Country
China
ProdList
40228
Advantage
62
3B Pharmachem (Wuhan) International Co.,Ltd.
Tel
821-50328103-801 18930552037
Fax
86-21-50328109
Email
3bsc@sina.com
Country
China
ProdList
15838
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69
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View Lastest Price from (S)-1-Boc-3-methylpiperazine manufacturers

Hefei Lbao Physical & Chemical Science Co.,Ltd
Product
(S)-tert-Butyl 3-methylpiperazine-1-carboxylate 147081-29-6
Price
US $0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
Customise
Release date
2025-10-28
Henan Aochuang Chemical Co.,Ltd.
Product
(S)-4-N-Boc-2-methylpiperazine 147081-29-6
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
1Ton
Release date
2022-10-08
Shanghai UCHEM Inc.
Product
(S)-4-N-Boc-2-methylpiperazine 147081-29-6
Price
US $37.00-788.00/g
Min. Order
10g
Purity
0.99
Supply Ability
25kg
Release date
2023-12-15

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  • 147081-29-6