| Formula | C6H12O2 |
| MW | 116.16 |
| InChIKey | JZUPYBRYQINNRE-UHFFFAOYSA-N |
| pubchem_compound_cid | 24984 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 65 |
| pubchem_cactvs_hbond_acceptor | 2 |
| pubchem_cactvs_hbond_donor | 0 |
| pubchem_cactvs_rotatable_bond | 0 |
| pubchem_cactvs_subskeys | AAADccBgMAAAAAAAAAAAAAAAAAAAAAAAAAAkAAAAAAAAAAAAAAAAGgAAAAAACBSggAICAAAABAAAAAAAAAAAAAAAAAAAAAAAAAABAAAAAAACAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2,6-dimethyl-1,4-dioxane |
| pubchem_iupac_cas_name | 2,6-dimethyl-1,4-dioxane |
| pubchem_iupac_systematic_name | 2,6-dimethyl-1,4-dioxane |
| pubchem_iupac_traditional_name | 2,6-dimethyl-1,4-dioxane |
| pubchem_iupac_inchi | InChI=1S/C6H12O2/c1-5-3-7-4-6(2)8-5/h5-6H,3-4H2,1-2H3 |
| pubchem_iupac_inchikey | JZUPYBRYQINNRE-UHFFFAOYSA-N |
| pubchem_xlogp3_aa | 0.6 |
| pubchem_exact_mass | 116.08373 |
| pubchem_molecular_formula | C6H12O2 |
| pubchem_molecular_weight | 116.15828 |
| pubchem_openeye_can_smiles | CC1COCC(O1)C |
| pubchem_openeye_iso_smiles | CC1COCC(O1)C |
| pubchem_cactvs_tpsa | 18.5 |
| pubchem_monoisotopic_weight | 116.08373 |
| pubchem_total_charge | 0 |
| pubchem_heavy_atom_count | 8 |
| 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_coordinate_type | 1 |
| pubchem_bondannotations | 3 7 3
4 8 3 |
| pubchem_xlogp3 | 0 |
