2,6-diphosphonohexan-2-ylphosphonic acid

Systemtic Name: 2,6-diphosphonohexan-2-ylphosphonic acid Openeye Name: 5,5-diphosphonohexylphosphonic acid CAS Name: 2,6-diphosphonohexan-2-ylphosphonic acid IUPAC Name: 2,6-diphosphonohexan-2-ylphosphonic acid Traditional Name: 5,5-diphosphonohexylphosphonic acid Formula: C6H17O9P3 MolecularWeight: 326.115063

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCP(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CCCCP(=O)(O)O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H17O9P3/c1-6(17(10,11)12,18(13,14)15)4-2-3-5-16(7,8)9/h2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)