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bis(4-octylphenyl) phosphono phosphate

bis(4-octylphenyl) phosphono phosphate

Systemtic Name:bis(4-octylphenyl) phosphono phosphate
Openeye Name:bis(4-octylphenyl) phosphono phosphate
CAS Name:phosphoric acid bis(4-octylphenyl) phosphono ester
IUPAC Name:bis(4-octylphenyl) phosphono phosphate
Traditional Name:phosphoric acid bis(4-octylphenyl) phosphono ester
Formula: C28H44O7P2
MolecularWeight: 554.592282
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)CCCCCCCC)OP(=O)(O)O


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)CCCCCCCC)OP(=O)(O)O


InChI

InChI=1S/C28H44O7P2/c1-3-5-7-9-11-13-15-25-17-21-27(22-18-25)33-37(32,35-36(29,30)31)34-28-23-19-26(20-24-28)16-14-12-10-8-6-4-2/h17-24H,3-16H2,1-2H3,(H2,29,30,31)


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