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tris(3,4-diethyloctan-3-yl) phosphate

tris(3,4-diethyloctan-3-yl) phosphate

Systemtic Name:tris(3,4-diethyloctan-3-yl) phosphate
Openeye Name:tris(1,1,2-triethylhexyl) phosphate
CAS Name:phosphoric acid tris(3,4-diethyloctan-3-yl) ester
IUPAC Name:tris(3,4-diethyloctan-3-yl) phosphate
Traditional Name:phosphoric acid tris(1,1,2-triethylhexyl) ester
Formula: C36H75O4P
MolecularWeight: 602.952061
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C36H75O4P/c1-13-25-28-31(16-4)34(19-7,20-8)38-41(37,39-35(21-9,22-10)32(17-5)29-26-14-2)40-36(23-11,24-12)33(18-6)30-27-15-3/h31-33H,13-30H2,1-12H3


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