isobutyl hydrogen phthalate
- Product Nameisobutyl hydrogen phthalate
- CAS30833-53-5
- MFC12H14O4
- MW222.23716
- EINECS2503526
- MOL File30833-53-5.mol
Chemical Properties
| Melting point | 78-80°C |
| Boiling point | 283.41°C (rough estimate) |
| Density | 1.0643 (rough estimate) |
| refractive index | 1.4560 (estimate) |
| storage temp. | Refrigerator |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 3.37±0.36(Predicted) |
| color | White |
| biological source | synthetic |
| InChI | 1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14) |
| InChIKey | RZJSUWQGFCHNFS-UHFFFAOYSA-N |
| SMILES | O(CC(C)C)C(=O)c1c(cccc1)C(=O)O |