1-bromanyl-2-methyl-5,5-diphosphonato-pentan-2-ol

Systemtic Name: 1-bromanyl-2-methyl-5,5-diphosphonato-pentan-2-ol Openeye Name: 1-bromo-2-methyl-5,5-diphosphonato-pentan-2-ol CAS Name: 1-bromo-2-methyl-5,5-diphosphonato-2-pentanol IUPAC Name: 1-bromo-2-methyl-5,5-diphosphonatopentan-2-ol Traditional Name: 1-bromo-2-methyl-5,5-diphosphonato-pentan-2-ol Formula: C6H11BrO7P2-4 MolecularWeight: 336.998862

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(P(=O)([O-])[O-])P(=O)([O-])[O-])(CBr)O

Isomeric SMILES

CC(CCC(P(=O)([O-])[O-])P(=O)([O-])[O-])(CBr)O

InChI

InChI=1S/C6H15BrO7P2/c1-6(8,4-7)3-2-5(15(9,10)11)16(12,13)14/h5,8H,2-4H2,1H3,(H2,9,10,11)(H2,12,13,14)/p-4