339023-01-7
2-((4-BENZYLPIPERAZINO)(DIMETHYLAMINO)METHYLENE)MALONONITRILE
Name2-((4-BENZYLPIPERAZINO)(DIMETHYLAMINO)METHYLENE)MALONONITRILE
1Identification
【Name】
2-((4-BENZYLPIPERAZINO)(DIMETHYLAMINO)METHYLENE)MALONONITRILE
【CAS】
【MDL】
MFCD00139234
【English Synonyms】
【Formula】
C17 H21 N5
【MolWeight】
295.388
【Inchi】
InChI=1S/C17H21N5/c1-20(2)17(16(12-18)13-19)22-10-8-21(9-11-22)14-15-6-4-3-5-7-15/h3-7H,8-11,14H2,1-2H3
【InChIKey】
InChIKey=LGWIZCUHHRIWDQ-UHFFFAOYSA-N
【SMILES】
CN(C)C(=C(C#N)C#N)N1CCN(CC1)Cc2ccccc2
【MOL File】
2-((4-BENZYLPIPERAZI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-((4-BENZYLPIPERAZINO)(DIMETHYLAMINO)METHYLENE)MALONONITRILE.cml