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bis(2-ethylhexyl) phosphate; methyl(trioctyl)azanium

bis(2-ethylhexyl) phosphate; methyl(trioctyl)azanium

Systemtic Name:bis(2-ethylhexyl) phosphate; methyl(trioctyl)azanium
Openeye Name:bis(2-ethylhexyl) phosphate; methyl(trioctyl)ammonium
CAS Name:bis(2-ethylhexyl) phosphate; methyl(trioctyl)ammonium
IUPAC Name:bis(2-ethylhexyl) phosphate; methyl(trioctyl)azanium
Traditional Name:bis(2-ethylhexyl) phosphate; methyl(trioctyl)ammonium
Formula: C41H88NO4P
MolecularWeight: 690.115481
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.CCCCC(CC)COP(=O)([O-])OCC(CC)CCCC


Isomeric SMILES

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.CCCCC(CC)COP(=O)([O-])OCC(CC)CCCC


InChI

InChI=1S/C25H54N.C16H35O4P/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6-2/h5-25H2,1-4H3;15-16H,5-14H2,1-4H3,(H,17,18)/q+1;/p-1


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