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3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile

CAS No.
859850-90-1
Chemical Name:
3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile
Synonyms
3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile;Benzonitrile,3-[(4-methyl-1-piperazinyl)methyl]-
CBNumber:
CB7302116
Molecular Formula:
C13H17N3
Molecular Weight:
215.29
MDL Number:
MFCD07772861
MOL File:
859850-90-1.mol
MSDS File:
SDS
Last updated:2026-09-12 18:54:54

3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile Properties

storage temp. 2-8°C

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P280-P305+P351+P338-P310
HS Code  2933599590
NFPA 704
1
3 0

3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Apolloscientific OR111034 3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile 95% 859850-90-1 250mg $41 2026-06-04 Buy
Activate Scientific AS42615 3-((4-Methylpiperazin-1-yl)methyl)benzonitrile 95% 859850-90-1 1g $55 2026-06-04 Buy
Apolloscientific OR111034 3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile 95% 859850-90-1 500mg $55 2026-06-04 Buy
Activate Scientific AS42615 3-((4-Methylpiperazin-1-yl)methyl)benzonitrile 95% 859850-90-1 5g $158 2026-06-04 Buy
Matrix Scientific 126990 3-((4-Methylpiperazin-1-yl)methyl)benzonitrile 859850-90-1 1.00g $504 2026-05-18 Buy
Product number Packaging Price Buy
OR111034 250mg $41 Buy
AS42615 1g $55 Buy
OR111034 500mg $55 Buy
AS42615 5g $158 Buy
126990 1.00g $504 Buy

3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile Chemical Properties, Uses, Production

Uses

3-((4-Methylpiperazin-1-yl)methyl)benzonitrile is involved in the preparation of N-Hydroxyphenylacrylamides and N-Hydroxypyridin-2-ylacrylamides as novel histone deacetylase inhibitors.

Synthesis

1-Methylpiperazine

109-01-3

3-Cyanobenzaldehyde

24964-64-5

3-[(4-METHYLPIPERAZIN-1-YL)METHYL]BENZONITRILE

859850-90-1

General procedure for the synthesis of 3-((4-methylpiperazin-1-yl)methyl)benzonitrile from N-methylpiperazine and 3-cyanobenzaldehyde: Step 1: 3-Formylbenzonitrile (1.5 g, 11.45 mmol), N-methylpiperazine (1.49 g, 14.9 mmol) and sodium triacetoxyborohydride (3.63 g, 17.18 mmol) were dissolved in dichloromethane (75 ml), acetic acid (0.851 ml, 14.9 mmol) was added and the reaction was stirred at room temperature overnight. After completion of the reaction, the reaction mixture was diluted with dichloromethane and washed with 1 M sodium carbonate solution. The organic phase was dried with anhydrous sodium sulfate and concentrated under reduced pressure. The crude product was purified by column chromatography (eluent: dichloromethane/methanol/ammonia = 97:3:0.5) to give 3-(4-methylpiperazin-1-ylmethyl)benzonitrile 1.7 g in 70% yield.

References

[1] Patent: WO2007/113249, 2007, A2. Location in patent: Page/Page column 60-61
[2] Journal of Medicinal Chemistry, 2010, vol. 53, # 2, p. 822 - 839
[3] Patent: EP2033956, 2009, A1. Location in patent: Page/Page column 13
[4] Patent: WO2006/130075, 2006, A1. Location in patent: Page/Page column 25-26

109-01-3
24964-64-5
859850-90-1
Synthesis of 3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile from 1-Methylpiperazine and 3-Cyanobenzaldehyde

3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile Preparation Products And Raw materials

3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile Suppliers

Global Suppliers ( 37)
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Benzonitrile,3-[(4-methyl-1-piperazinyl)methyl]- 3-[(4-Methylpiperazin-1-yl)methyl]benzonitrile 859850-90-1