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4-octylphenolate; tetraphenylphosphanium

4-octylphenolate; tetraphenylphosphanium

Systemtic Name:4-octylphenolate; tetraphenylphosphanium
Openeye Name:4-octylphenolate; tetraphenylphosphonium
CAS Name:4-octylphenolate; tetraphenylphosphonium
IUPAC Name:4-octylphenolate; tetraphenylphosphanium
Traditional Name:4-octylphenolate; tetraphenylphosphonium
Formula: C38H41OP
MolecularWeight: 544.705301
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4


InChI

InChI=1S/C24H20P.C14H22O/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h1-20H;9-12,15H,2-8H2,1H3/q+1;/p-1


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