5,7-DIMETHYLADAMANTANE-1,3-DICARBOXYLIC ACID
- Product Name5,7-DIMETHYLADAMANTANE-1,3-DICARBOXYLIC ACID
- CAS13928-68-2
- CBNumberCB11484257
- MFC14H20O4
- MW252.31
- MDL NumberMFCD01825788
- MOL File13928-68-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 273-274℃ (acetic acid ) |
| Boiling point | 371.4±15.0 °C(Predicted) |
| Density | 1.379±0.06 g/cm3 (20 ºC 760 Torr) |
| pka | 4.26±0.70(Predicted) |
| form | solid |
| InChI | 1S/C14H20O4/c1-11-3-12(2)6-13(4-11,9(15)16)8-14(5-11,7-12)10(17)18/h3-8H2,1-2H3,(H,15,16)(H,17,18)/t11-,12+,13+,14- |
| InChIKey | KGFHKUZOSKDAKW-LVEBTZEWSA-N |
| SMILES | C[C@]12C[C@]3(C)C[C@](C1)(C[C@](C2)(C3)C(O)=O)C(O)=O |
| UNSPSC Code | 12352106 |
| NACRES | NA.21 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302-H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral |