trihexadecan-5-yl phosphate

Systemtic Name: trihexadecan-5-yl phosphate Openeye Name: tris(1-butyldodecyl) phosphate CAS Name: phosphoric acid trihexadecan-5-yl ester IUPAC Name: trihexadecan-5-yl phosphate Traditional Name: phosphoric acid tris(1-butyldodecyl) ester Formula: C48H99O4P MolecularWeight: 771.271021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C48H99O4P/c1-7-13-19-22-25-28-31-34-37-43-46(40-16-10-4)50-53(49,51-47(41-17-11-5)44-38-35-32-29-26-23-20-14-8-2)52-48(42-18-12-6)45-39-36-33-30-27-24-21-15-9-3/h46-48H,7-45H2,1-6H3