2-ethylhexanoate; tricyclohexylphosphanium

Systemtic Name: 2-ethylhexanoate; tricyclohexylphosphanium Openeye Name: 2-ethylhexanoate; tricyclohexylphosphonium CAS Name: 2-ethylhexanoate; tricyclohexylphosphonium IUPAC Name: 2-ethylhexanoate; tricyclohexylphosphanium Traditional Name: 2-ethylhexanoate; tricyclohexylphosphonium Formula: C26H49O2P MolecularWeight: 424.639821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3

Isomeric SMILES

CCCCC(CC)C(=O)[O-].C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3

InChI

InChI=1S/C18H33P.C8H16O2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-6-7(4-2)8(9)10/h16-18H,1-15H2;7H,3-6H2,1-2H3,(H,9,10)