| Formula | HIO |
| MW | 143.91 |
| InChIKey | GEOVEUCEIQCBKH-UHFFFAOYNA-N |
| Entry_Date | 2023-11-01 |
| Net_Charge | 0 |
| Number_Atoms | 3 |
| Number_Heavy_Atoms | 2 |
| Number_Rings | 0 |
| Number_Bonds | 2 |
| Rotat_Bonds | 0 |
| Unbranched_Chain | 2 |
| Chiral_Centers | 0 |
| ONatoms | 1 |
| HB_Donor | 1 |
| HB_Acceptor | 1 |
| OpenEye_HB_Donors | 1 |
| OpenEye_HB_Acceptors | 1 |
| Lipinski_HB_Donors | 1 |
| Lipinski_HB_Acceptors | 1 |
| Lipinski_Violations | 0 |
| XLogP3 | 0 |
| XLogP | 0.56 |
| logP | 0.7089 |
| PSA | 20.23 |
| MR | 15.9558 |
| ABS | 0.55 |
| Solubility | highly |
| Aggregator | Pass |
| PM7_Heat_of_Formation_kcal_per_mol | -3.00136 |
| PM7_Total_Energy_ev | -530.92352 |
| PM7_Electronic_Energy_ev | -895.15244 |
| PM7_Dipole_Debye | 1.95575 |
| PM7_Point_Group | Cs |
| PM7_HOMO_Energy_ev | -8.786 |
| PM7_LUMO_Energy_ev | -0.426 |
| PM7_COSMO_Area_square_ang | 80.68 |
| PM7_COSMO_Volue_cubic_ang | 64.83 |
| PM7_Electron_Affinity_ev | 0.426 |
| PM7_Ionization_Energy_ev | 8.786 |
| PM7_Energy_Gap_ev | 8.36 |
| PM7_Global_Hardness_ev | 4.18 |
| PM7_Global_Softness_ev | 0.23923444976076555 |
| PM7_Chemical_Potential_ev | -4.606 |
| PM7_Electronigativity_ev | 4.606 |
| PM7_Back_Donation_Energy_ev | -1.045 |
| PM7_Electrophilicity_ev | 2.5377076555023925 |
| OPENEYE_Name | hypoiodous acid |
| SMILES | OI |
| Canonical_SMILES | OI |
| InChI | 1/HIO/c1-2/h2H |
| InChI_3D | 1S/HIO/c1-2/h2H |
| AuxInfo | 1/0/N:2,1/rA:3nOIH/rB:s1;s1;/rC:;1,0,0;-.25,-.433,0; |
| Duplicates | ChEBI29231;ChEBI29232;ChEBI29896_s0;ChEBI29900_s0 |
| mol2_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29231.mol2 |
| pdbqt_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29231.pdbqt |
| sdf_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29231.sdf |