869856-09-7
1-(2,3-DICHLOROPHENYL)-4-[4-(3-NITROPHENOXY)BUTYL]-PIPERAZINE
Name1-(2,3-DICHLOROPHENYL)-4-[4-(3-NITROPHENOXY)BUTYL]-PIPERAZINE
1Identification
【Name】
1-(2,3-DICHLOROPHENYL)-4-[4-(3-NITROPHENOXY)BUTYL]-PIPERAZINE
【CAS】
【MDL】
MFCD12913402
【English Synonyms】
【Formula】
C20 H23 Cl2 N3 O3
【MolWeight】
424.326
【Inchi】
InChI=1S/C20H23Cl2N3O3/c21-18-7-4-8-19(20(18)22)24-12-10-23(11-13-24)9-1-2-14-28-17-6-3-5-16(15-17)25(26)27/h3-8,15H,1-2,9-14H2
【InChIKey】
InChIKey=VGEQWXCHXSDDIH-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)OCCCCN2CCN(CC2)c3cccc(c3Cl)Cl)[N+](=O)[O-]
【MOL File】
1-(2,3-DICHLOROPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2,3-DICHLOROPHENYL)-4-[4-(3-NITROPHENOXY)BUTYL]-PIPERAZINE.cml