| CID | 33 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 20 |
| pubchem_cactvs_hbond_acceptor | 1 |
| pubchem_cactvs_hbond_donor | 0 |
| pubchem_cactvs_rotatable_bond | 1 |
| pubchem_cactvs_subskeys | AAADcQBAIAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgIAAAAAAAOggEIAAAAAAAAIAAgQgAAAAAAAAAAAAAAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2-chloroacetaldehyde |
| pubchem_iupac_cas_name | 2-chloroacetaldehyde |
| pubchem_iupac_systematic_name | 2-chloroethanal |
| pubchem_iupac_traditional_name | 2-chloroacetaldehyde |
| pubchem_nist_inchi | InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2 |
| pubchem_cactvs_xlogp | 0 |
| pubchem_exact_mass | 77.987242 |
| pubchem_molecular_formula | C2H3ClO |
| pubchem_molecular_weight | 78.49762 |
| pubchem_openeye_can_smiles | C(C=O)Cl |
| pubchem_openeye_iso_smiles | C(C=O)Cl |
| pubchem_cactvs_tpsa | 17.1 |
| pubchem_monoisotopic_weight | 77.987242 |
| pubchem_total_charge | 0 |
| pubchem_heavy_atom_count | 4 |
| 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 | 2 |
