| CID | 45 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 103 |
| pubchem_cactvs_hbond_acceptor | 5 |
| pubchem_cactvs_hbond_donor | 3 |
| pubchem_cactvs_rotatable_bond | 2 |
| pubchem_cactvs_subskeys | AAADcYBAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAIACAAAAgAIAACQCAIAAAAAAAAAAAFAAAABEAQIAAAAQAABIAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2-hydroxypropanedioic acid |
| pubchem_iupac_cas_name | 2-hydroxypropanedioic acid |
| pubchem_iupac_systematic_name | 2-hydroxypropanedioic acid |
| pubchem_iupac_traditional_name | 2-hydroxymalonic acid |
| pubchem_nist_inchi | InChI=1S/C3H4O5/c4-1(2(5)6)3(7)8/h1,4H,(H,5,6)(H,7,8) |
| pubchem_cactvs_xlogp | 0 |
| pubchem_exact_mass | 120.005873 |
| pubchem_molecular_formula | C3H4O5 |
| pubchem_molecular_weight | 120.06086 |
| 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 | 94.8 |
| pubchem_monoisotopic_weight | 120.005873 |
| pubchem_total_charge | 0 |
| 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 |
