[2,3-bis(2-ethylhexyl)phenyl]phosphonic acid

Systemtic Name: [2,3-bis(2-ethylhexyl)phenyl]phosphonic acid Openeye Name: [2,3-bis(2-ethylhexyl)phenyl]phosphonic acid CAS Name: [2,3-bis(2-ethylhexyl)phenyl]phosphonic acid IUPAC Name: [2,3-bis(2-ethylhexyl)phenyl]phosphonic acid Traditional Name: [2,3-bis(2-ethylhexyl)phenyl]phosphonic acid Formula: C22H39O3P MolecularWeight: 382.517021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C(=CC=C1)P(=O)(O)O)CC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CC1=C(C(=CC=C1)P(=O)(O)O)CC(CC)CCCC

InChI

InChI=1S/C22H39O3P/c1-5-9-12-18(7-3)16-20-14-11-15-22(26(23,24)25)21(20)17-19(8-4)13-10-6-2/h11,14-15,18-19H,5-10,12-13,16-17H2,1-4H3,(H2,23,24,25)