trihexadecan-7-yl phosphate

Systemtic Name: trihexadecan-7-yl phosphate Openeye Name: tris(1-hexyldecyl) phosphate CAS Name: phosphoric acid trihexadecan-7-yl ester IUPAC Name: trihexadecan-7-yl phosphate Traditional Name: phosphoric acid tris(1-hexyldecyl) ester Formula: C48H99O4P MolecularWeight: 771.271021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCC)OP(=O)(OC(CCCCCC)CCCCCCCCC)OC(CCCCCC)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(CCCCCC)OP(=O)(OC(CCCCCC)CCCCCCCCC)OC(CCCCCC)CCCCCCCCC

InChI

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