[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] dihydrogen phosphate; 5-bromanylpentan-2-ol

Systemtic Name: [2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] dihydrogen phosphate; 5-bromanylpentan-2-ol Openeye Name: 5-bromopentan-2-ol; [3-hydroxy-2,2-bis(hydroxymethyl)propyl] dihydrogen phosphate CAS Name: 5-bromo-2-pentanol; [3-hydroxy-2,2-bis(hydroxymethyl)propyl] dihydrogen phosphate IUPAC Name: 5-bromopentan-2-ol; [3-hydroxy-2,2-bis(hydroxymethyl)propyl] dihydrogen phosphate Traditional Name: 5-bromopentan-2-ol; (3-hydroxy-2,2-dimethylol-propyl) dihydrogen phosphate Formula: C10H24BrO8P MolecularWeight: 383.170521

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCBr)O.C(C(CO)(CO)COP(=O)(O)O)O

Isomeric SMILES

CC(CCCBr)O.C(C(CO)(CO)COP(=O)(O)O)O

InChI

InChI=1S/C5H11BrO.C5H13O7P/c1-5(7)3-2-4-6;6-1-5(2-7,3-8)4-12-13(9,10)11/h5,7H,2-4H2,1H3;6-8H,1-4H2,(H2,9,10,11)