tris(5-butylheptadecan-5-yl) phosphate

Systemtic Name: tris(5-butylheptadecan-5-yl) phosphate Openeye Name: tris(1,1-dibutyltridecyl) phosphate CAS Name: phosphoric acid tris(5-butylheptadecan-5-yl) ester IUPAC Name: tris(5-butylheptadecan-5-yl) phosphate Traditional Name: phosphoric acid tris(1,1-dibutyltridecyl) ester Formula: C63H129O4P MolecularWeight: 981.669721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCC)(CCCC)OP(=O)(OC(CCCC)(CCCC)CCCCCCCCCCCC)OC(CCCC)(CCCC)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCCC)(CCCC)OP(=O)(OC(CCCC)(CCCC)CCCCCCCCCCCC)OC(CCCC)(CCCC)CCCCCCCCCCCC

InChI

InChI=1S/C63H129O4P/c1-10-19-28-31-34-37-40-43-46-49-58-61(52-22-13-4,53-23-14-5)65-68(64,66-62(54-24-15-6,55-25-16-7)59-50-47-44-41-38-35-32-29-20-11-2)67-63(56-26-17-8,57-27-18-9)60-51-48-45-42-39-36-33-30-21-12-3/h10-60H2,1-9H3