tris(5-butyl-6-ethyl-decan-5-yl) phosphate

Systemtic Name: tris(5-butyl-6-ethyl-decan-5-yl) phosphate Openeye Name: tris(1,1-dibutyl-2-ethyl-hexyl) phosphate CAS Name: phosphoric acid tris(5-butyl-6-ethyldecan-5-yl) ester IUPAC Name: tris(5-butyl-6-ethyldecan-5-yl) phosphate Traditional Name: phosphoric acid tris(1,1-dibutyl-2-ethyl-hexyl) ester Formula: C48H99O4P MolecularWeight: 771.271021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(CCCC)(CCCC)OP(=O)(OC(CCCC)(CCCC)C(CC)CCCC)OC(CCCC)(CCCC)C(CC)CCCC

Isomeric SMILES

CCCCC(CC)C(CCCC)(CCCC)OP(=O)(OC(CCCC)(CCCC)C(CC)CCCC)OC(CCCC)(CCCC)C(CC)CCCC

InChI

InChI=1S/C48H99O4P/c1-13-25-34-43(22-10)46(37-28-16-4,38-29-17-5)50-53(49,51-47(39-30-18-6,40-31-19-7)44(23-11)35-26-14-2)52-48(41-32-20-8,42-33-21-9)45(24-12)36-27-15-3/h43-45H,13-42H2,1-12H3