2-phosphonohexan-2-ylphosphonic acid

Systemtic Name: 2-phosphonohexan-2-ylphosphonic acid Openeye Name: (1-methyl-1-phosphono-pentyl)phosphonic acid CAS Name: 2-phosphonohexan-2-ylphosphonic acid IUPAC Name: 2-phosphonohexan-2-ylphosphonic acid Traditional Name: (1-methyl-1-phosphono-pentyl)phosphonic acid Formula: C6H16O6P2 MolecularWeight: 246.135162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H16O6P2/c1-3-4-5-6(2,13(7,8)9)14(10,11)12/h3-5H2,1-2H3,(H2,7,8,9)(H2,10,11,12)