(5,6-dibutyl-6-phosphono-decan-5-yl)phosphonic acid

Systemtic Name: (5,6-dibutyl-6-phosphono-decan-5-yl)phosphonic acid Openeye Name: (1,1,2-tributyl-2-phosphono-hexyl)phosphonic acid CAS Name: (5,6-dibutyl-6-phosphonodecan-5-yl)phosphonic acid IUPAC Name: (5,6-dibutyl-6-phosphonodecan-5-yl)phosphonic acid Traditional Name: (1,1,2-tributyl-2-phosphono-hexyl)phosphonic acid Formula: C18H40O6P2 MolecularWeight: 414.454122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(CCCC)(CCCC)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCC(CCCC)(C(CCCC)(CCCC)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C18H40O6P2/c1-5-9-13-17(14-10-6-2,25(19,20)21)18(15-11-7-3,16-12-8-4)26(22,23)24/h5-16H2,1-4H3,(H2,19,20,21)(H2,22,23,24)