685536-08-7
4-[(3-METHYL-1-PIPERAZINYL)METHYL]BENZONITRILE
Name4-[(3-METHYL-1-PIPERAZINYL)METHYL]BENZONITRILE
1Identification
【Name】
4-[(3-METHYL-1-PIPERAZINYL)METHYL]BENZONITRILE
【CAS】
【MDL】
MFCD16038677
【English Synonyms】
【Formula】
C13 H17 N3
【MolWeight】
215.298
【Inchi】
InChI=1S/C13H17N3/c1-11-9-16(7-6-15-11)10-13-4-2-12(8-14)3-5-13/h2-5,11,15H,6-7,9-10H2,1H3
【InChIKey】
InChIKey=FJOMKZCZBVJOKH-UHFFFAOYSA-N
【SMILES】
CC1CN(CCN1)Cc2ccc(cc2)C#N
【MOL File】
4-[(3-METHYL-1-PIPER….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[(3-METHYL-1-PIPERAZINYL)METHYL]BENZONITRILE.cml