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Reference substances

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IUPAC name:
8,8'-(4-hexyl-3-(octa-2-en-4,6-diyn-1-yl)-1,2-phenylene)bis(N-(3-(dimethylamino)propyl)octanamide) compound with dihydrogen (1:3)

Inventory

Synonyms

Molecular and structural information

Molecular formula:
C46H82N4O2
Molecular weight:
723.19
SMILES notation:
CN(CCCN([H])C(CCCCCCCC1=C(CCCCCCCC(N(CCCN(C)C)[H])=O)C(CC=CC#CC#CC)=C(CCCCCC)C=C1)=O)C.[HH].[HH].[HH]
InChl:
InChI=1S/C46H76N4O2.3H2/c1-7-9-11-13-17-23-31-43-41(29-21-12-10-8-2)35-36-42(30-22-16-14-19-25-33-45(51)47-37-27-39-49(3)4)44(43)32-24-18-15-20-26-34-46(52)48-38-28-40-50(5)6;;;/h17,23,35-36H,8,10,12,14-16,18-22,24-34,37-40H2,1-6H3,(H,47,51)(H,48,52);3*1H
Structural formula:
Chemical structure

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