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trioctyl-(phenylmethyl)phosphanium ethanoate

trioctyl-(phenylmethyl)phosphanium ethanoate

Systemtic Name:trioctyl-(phenylmethyl)phosphanium ethanoate
Openeye Name:benzyl(trioctyl)phosphonium acetate
CAS Name:trioctyl-(phenylmethyl)phosphonium acetate
IUPAC Name:benzyl(trioctyl)phosphanium acetate
Traditional Name:benzyl(trioctyl)phosphonium acetate
Formula: C33H61O2P
MolecularWeight: 520.810001
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1.CC(=O)[O-]


Isomeric SMILES

CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1.CC(=O)[O-]


InChI

InChI=1S/C31H58P.C2H4O2/c1-4-7-10-13-16-22-27-32(28-23-17-14-11-8-5-2,29-24-18-15-12-9-6-3)30-31-25-20-19-21-26-31;1-2(3)4/h19-21,25-26H,4-18,22-24,27-30H2,1-3H3;1H3,(H,3,4)/q+1;/p-1


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