70403-11-1
(1,4-DIBENZYL-PIPERAZIN-2-YL)-ACETONITRILE
Name(1,4-DIBENZYL-PIPERAZIN-2-YL)-ACETONITRILE
1Identification
【Name】
(1,4-DIBENZYL-PIPERAZIN-2-YL)-ACETONITRILE
【CAS】
【MDL】
MFCD11500626
【English Synonyms】
【Formula】
C20 H23 N3
【MolWeight】
305.423
【Inchi】
InChI=1S/C20H23N3/c21-12-11-20-17-22(15-18-7-3-1-4-8-18)13-14-23(20)16-19-9-5-2-6-10-19/h1-10,20H,11,13-17H2
【InChIKey】
InChIKey=NMFYHCYOYUZSSI-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)CN2CCN(C(C2)CC#N)Cc3ccccc3
【MOL File】
(1,4-DIBENZYL-PIPERA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(1,4-DIBENZYL-PIPERAZIN-2-YL)-ACETONITRILE.cml