| CID | 44 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 92 |
| pubchem_cactvs_hbond_acceptor | 5 |
| pubchem_cactvs_hbond_donor | 1 |
| pubchem_cactvs_rotatable_bond | 0 |
| pubchem_cactvs_subskeys | AAADcQBAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAIACAAAAgAIAACQCAIAAAAAAAAAAAFAAAABEAQIAAAAAAABIAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2-hydroxypropanedioate |
| pubchem_iupac_cas_name | 2-hydroxypropanedioate |
| pubchem_iupac_systematic_name | 2-hydroxypropanedioate |
| pubchem_iupac_traditional_name | 2-hydroxymalonate |
| pubchem_nist_inchi | InChI=1S/C3H4O5/c4-1(2(5)6)3(7)8/h1,4H,(H,5,6)(H,7,8)/p-2 |
| pubchem_cactvs_xlogp | 0 |
| pubchem_exact_mass | 117.990223 |
| pubchem_molecular_formula | C3H2O5-2 |
| pubchem_molecular_weight | 118.04498 |
| pubchem_openeye_can_smiles | C(C(=O)[O-])(C(=O)[O-])O |
| pubchem_openeye_iso_smiles | C(C(=O)[O-])(C(=O)[O-])O |
| pubchem_cactvs_tpsa | 101 |
| pubchem_monoisotopic_weight | 117.990223 |
| pubchem_total_charge | -2 |
| pubchem_heavy_atom_count | 8 |
| pubchem_atom_def_stereo_count | 0 |
| pubchem_atom_udef_stereo_count | 0 |
| pubchem_bond_def_stereo_count | 0 |
| pubchem_bond_udef_stereo_count | 0 |
| pubchem_isotopic_atom_count | 0 |
| pubchem_component_count | 1 |
| pubchem_cactvs_tauto_count | 1 |
