2-phosphonopentan-2-ylphosphonic acid

Systemtic Name: 2-phosphonopentan-2-ylphosphonic acid Openeye Name: (1-methyl-1-phosphono-butyl)phosphonic acid CAS Name: 2-phosphonopentan-2-ylphosphonic acid IUPAC Name: 2-phosphonopentan-2-ylphosphonic acid Traditional Name: (1-methyl-1-phosphono-butyl)phosphonic acid Formula: C5H14O6P2 MolecularWeight: 232.108582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H14O6P2/c1-3-4-5(2,12(6,7)8)13(9,10)11/h3-4H2,1-2H3,(H2,6,7,8)(H2,9,10,11)