2-((4-methylpiperazin-1-yl)methaneyl)benzonitrile

Modify Date: 2025-08-25 16:19:41

2-((4-methylpiperazin-1-yl)methaneyl)benzonitrile Structure
2-((4-methylpiperazin-1-yl)methaneyl)benzonitrile structure
Common Name 2-((4-methylpiperazin-1-yl)methaneyl)benzonitrile
CAS Number 864069-00-1 Molecular Weight 215.29400
Density 1.11g/cm3 Boiling Point 329.3ºC at 760 mmHg
Molecular Formula C13H17N3 Melting Point N/A
MSDS N/A Flash Point 136.4ºC

 Names

Name 2-[(4-methylpiperazin-1-yl)methyl]benzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.11g/cm3
Boiling Point 329.3ºC at 760 mmHg
Molecular Formula C13H17N3
Molecular Weight 215.29400
Flash Point 136.4ºC
Exact Mass 215.14200
PSA 30.27000
LogP 1.18148
Index of Refraction 1.587
InChIKey SZENQRLSNAOEPP-UHFFFAOYSA-N
SMILES CN1CCN(Cc2ccccc2C#N)CC1

 Safety Information

Hazard Codes Xn
HS Code 2933599090

 Synthetic Route

~73%

2-((4-methylpiperazin-1-yl)methaneyl)benzonitrile Structure

2-((4-methylpip...

CAS#:864069-00-1

Literature: Synlett, , # 3 art. no. S05710ST, p. 349 - 356

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933599090
Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

2-((4-methylpiperazin-1-yl)methyl)benzonitrile
2-[(4-Methyl-1-Piperazinyl)Methyl]-Benzonitrile
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