2-ethylhexan-1-amine; tridecyl dihydrogen phosphate

Systemtic Name: 2-ethylhexan-1-amine; tridecyl dihydrogen phosphate Openeye Name: 2-ethylhexan-1-amine; tridecyl dihydrogen phosphate CAS Name: 2-ethyl-1-hexanamine; tridecyl dihydrogen phosphate IUPAC Name: 2-ethylhexan-1-amine; tridecyl dihydrogen phosphate Traditional Name: 2-ethylhexylamine; tridecyl dihydrogen phosphate Formula: C29H67N2O4P MolecularWeight: 538.827041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOP(=O)(O)O.CCCCC(CC)CN.CCCCC(CC)CN

Isomeric SMILES

CCCCCCCCCCCCCOP(=O)(O)O.CCCCC(CC)CN.CCCCC(CC)CN

InChI

InChI=1S/C13H29O4P.2C8H19N/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-18(14,15)16;2*1-3-5-6-8(4-2)7-9/h2-13H2,1H3,(H2,14,15,16);2*8H,3-7,9H2,1-2H3