| Formula | C8H18O2 |
| MW | 146.23 |
| InChIKey | KYOBHZJMEUPABN-UHFFFAOYSA-N |
| pubchem_compound_cid | 24981 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 64 |
| pubchem_cactvs_hbond_acceptor | 2 |
| pubchem_cactvs_hbond_donor | 1 |
| pubchem_cactvs_rotatable_bond | 6 |
| pubchem_cactvs_subskeys | AAADceBwMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAADQCggAICAAAABgAAAAAAAAAAAAAAAAAAAAAAAAABEAIAAAACAAAEAAADAACAAAAMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 2-(2-methylpentoxy)ethanol |
| pubchem_iupac_cas_name | 2-(2-methylpentoxy)ethanol |
| pubchem_iupac_systematic_name | 2-(2-methylpentoxy)ethanol |
| pubchem_iupac_traditional_name | 2-(2-methylpentoxy)ethanol |
| pubchem_iupac_inchi | InChI=1S/C8H18O2/c1-3-4-8(2)7-10-6-5-9/h8-9H,3-7H2,1-2H3 |
| pubchem_iupac_inchikey | KYOBHZJMEUPABN-UHFFFAOYSA-N |
| pubchem_xlogp3_aa | 0 |
| pubchem_exact_mass | 146.13068 |
| pubchem_molecular_formula | C8H18O2 |
| pubchem_molecular_weight | 146.22732 |
| pubchem_openeye_can_smiles | CCCC(C)COCCO |
| pubchem_openeye_iso_smiles | CCCC(C)COCCO |
| pubchem_cactvs_tpsa | 29.5 |
| pubchem_monoisotopic_weight | 146.13068 |
| pubchem_total_charge | 0 |
| pubchem_heavy_atom_count | 10 |
| pubchem_atom_def_stereo_count | 0 |
| pubchem_atom_udef_stereo_count | 1 |
| 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 |
| pubchem_xlogp3 | 2 |
