octane; octylbenzene; phosphorous acid

Systemtic Name: octane; octylbenzene; phosphorous acid Openeye Name: octane; octylbenzene; phosphorous acid CAS Name: octane; octylbenzene; phosphorous acid IUPAC Name: octane; octylbenzene; phosphorous acid Traditional Name: n-octane; octylbenzene; phosphorous acid Formula: C22H43O3P MolecularWeight: 386.548781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CCCCCCCCC1=CC=CC=C1.OP(O)O

Isomeric SMILES

CCCCCCCC.CCCCCCCCC1=CC=CC=C1.OP(O)O

InChI

InChI=1S/C14H22.C8H18.H3O3P/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14;1-3-5-7-8-6-4-2;1-4(2)3/h7,9-10,12-13H,2-6,8,11H2,1H3;3-8H2,1-2H3;1-3H