23111-77-5
PIPERAZINIUM, 1,4-BIS(ALPHA-METHYLPHENETHYL)-1,4-DIALLYL-, DIBROMIDE
NamePIPERAZINIUM, 1,4-BIS(ALPHA-METHYLPHENETHYL)-1,4-DIALLYL-, DIBROMIDE
1Identification
【Name】
PIPERAZINIUM, 1,4-BIS(ALPHA-METHYLPHENETHYL)-1,4-DIALLYL-, DIBROMIDE
【CAS】
【MDL】
MFCD01748654
【English Synonyms】
【Formula】
C28 H40 N2 . 2 Br
【MolWeight】
564.446
【Inchi】
InChI=1S/C28H40N2.2BrH/c1-5-17-29(25(3)23-27-13-9-7-10-14-27)19-21-30(18-6-2,22-20-29)26(4)24-28-15-11-8-12-16-28;;/h5-16,25-26H,1-2,17-24H2,3-4H3;2*1H/q+2;;/p-2
【InChIKey】
InChIKey=YDESGOWCEPCZIA-UHFFFAOYSA-L
【SMILES】
CC(Cc1ccccc1)[N+]2(CC[N+](CC2)(CC=C)C(C)Cc3ccccc3)CC=C.[Br-].[Br-]
【MOL File】
PIPERAZINIUM, 1,4-BI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PIPERAZINIUM, 1,4-BIS(ALPHA-METHYLPHENETHYL)-1,4-DIALLYL-, DIBROMIDE.cml