| Formula | C7H16O3 |
| MW | 148.2 |
| InChIKey | OMAKZNALRADTRX-UHFFFAOYSA-N |
| pubchem_compound_cid | 24994 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 71 |
| pubchem_cactvs_hbond_acceptor | 3 |
| pubchem_cactvs_hbond_donor | 0 |
| pubchem_cactvs_rotatable_bond | 5 |
| pubchem_cactvs_subskeys | AAADceBgMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACBSwgAMCCAAABAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAgAAAFAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 1,1,3-trimethoxybutane |
| pubchem_iupac_cas_name | 1,1,3-trimethoxybutane |
| pubchem_iupac_systematic_name | 1,1,3-trimethoxybutane |
| pubchem_iupac_traditional_name | 1,1,3-trimethoxybutane |
| pubchem_iupac_inchi | InChI=1S/C7H16O3/c1-6(8-2)5-7(9-3)10-4/h6-7H,5H2,1-4H3 |
| pubchem_iupac_inchikey | OMAKZNALRADTRX-UHFFFAOYSA-N |
| pubchem_xlogp3_aa | 0.7 |
| pubchem_exact_mass | 148.109944 |
| pubchem_molecular_formula | C7H16O3 |
| pubchem_molecular_weight | 148.20014 |
| pubchem_openeye_can_smiles | CC(CC(OC)OC)OC |
| pubchem_openeye_iso_smiles | CC(CC(OC)OC)OC |
| pubchem_cactvs_tpsa | 27.7 |
| pubchem_monoisotopic_weight | 148.109944 |
| 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 | 5 13 3 |
| pubchem_xlogp3 | 0 |
