| CID | 64 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 176 |
| pubchem_cactvs_hbond_acceptor | 2 |
| pubchem_cactvs_hbond_donor | 2 |
| pubchem_cactvs_rotatable_bond | 0 |
| pubchem_cactvs_subskeys | AAADcYBgMAAGAAAAAAAAAAAAAAAAAAAAAAAiAAAAAAAAAAAAAAAAGgIACAAACBaggAIAAAAAAgCAACBCAAAAAAAgAAAACAAAAwgAFAAAAQAAEAAAAAAIEAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2,5-dichlorocyclohexa-2,5-diene-1,4-diol |
| pubchem_iupac_cas_name | 2,5-dichlorocyclohexa-2,5-diene-1,4-diol |
| pubchem_iupac_systematic_name | 2,5-dichlorocyclohexa-2,5-diene-1,4-diol |
| pubchem_iupac_traditional_name | 2,5-dichlorocyclohexa-2,5-diene-1,4-diol |
| pubchem_nist_inchi | InChI=1S/C6H6Cl2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,5-6,9-10H |
| pubchem_cactvs_xlogp | 0 |
| pubchem_exact_mass | 179.974485 |
| pubchem_molecular_formula | C6H6Cl2O2 |
| pubchem_molecular_weight | 181.01664 |
| pubchem_openeye_can_smiles | C1=C(C(C=C(C1O)Cl)O)Cl |
| pubchem_openeye_iso_smiles | C1=C(C(C=C(C1O)Cl)O)Cl |
| pubchem_cactvs_tpsa | 40.5 |
| pubchem_monoisotopic_weight | 179.974485 |
| pubchem_total_charge | 0 |
| pubchem_heavy_atom_count | 10 |
| pubchem_atom_def_stereo_count | 0 |
| pubchem_atom_udef_stereo_count | 2 |
| 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 |
| pubchem_bondannotations | 5 3 3
6 4 3 |
