Showing Metabocard for 2,4'-dihydroxyacetophenone (BASm0001922)
| Common Name | 2,4'-dihydroxyacetophenone |
|---|---|
| Description | Potential component of FEMA 3662. 2,4'-Dihydroxyacetophenone is a flavouring ingredien |
| Structure | |
| Molecular Formula | C8H8O3 |
| Average Mass | 152.14730 |
| Monoisotopic Mass | 152.04734 |
| IUPAC Name | 2-hydroxy-1-(4-hydroxyphenyl)ethan-1-one |
| Traditional Name | 2,4-dihydroxyacetophenone |
| CAS Registry Number | 5706-85-4 |
| SMILES | O=C(CO)c1ccc(O)cc1 |
| InChI Identifier | InChI=1S/C8H8O3/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,9-10H,5H2 |
| InChI Key | KLAKIAVEMQMVBT-UHFFFAOYSA-N |
| CHEBI ID | CHEBI:35164 |
| HMDB ID | HMDB0029657 |
| State | Not Available |
| Water Solubility | 1.13e+01 g/l |
| logP | 0.65 |
| logS | -1.13 |
| pKa (Strongest Acidic) | 7.69 |
| pKa (Strongest Basic) | -3.31 |
| Hydrogen Acceptor Count | 3 |
| Hydrogen Donor Count | 2 |
| Polar Surface Area | 57.53 Ų |
| Rotatable Bond Count | 2 |
| Physiological Charge | 0 |
| Formal Charge | 0 |
| Refractivity | 40.14 m³·mol⁻¹ |
| Polarizability | 14.94 |