1,3-bis(oxidanyl)propan-2-yl dihydrogen phosphate; calcium

Systemtic Name: 1,3-bis(oxidanyl)propan-2-yl dihydrogen phosphate; calcium Openeye Name: calcium; [2-hydroxy-1-(hydroxymethyl)ethyl] dihydrogen phosphate CAS Name: calcium; 1,3-dihydroxypropan-2-yl dihydrogen phosphate IUPAC Name: calcium; 1,3-dihydroxypropan-2-yl dihydrogen phosphate Traditional Name: calcium; (2-hydroxy-1-methylol-ethyl) dihydrogen phosphate Formula: C3H9CaO6P MolecularWeight: 212.151721

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)OP(=O)(O)O)O.[Ca]

Isomeric SMILES

C(C(CO)OP(=O)(O)O)O.[Ca]

InChI

InChI=1S/C3H9O6P.Ca/c4-1-3(2-5)9-10(6,7)8;/h3-5H,1-2H2,(H2,6,7,8);