Pinonic acid
- Product NamePinonic acid
- CAS61826-55-9
- MFC10H16O3
- MW184.23
- EINECS
- MOL File61826-55-9.mol
Chemical Properties
| Melting point | 104-107 °C (lit.) |
| Boiling point | 258.19°C (rough estimate) |
| Density | 1.0655 (rough estimate) |
| refractive index | 1.5230 (estimate) |
| pka | 4.72±0.10(Predicted) |
| form | solid |
| InChI | 1S/C10H16O3/c1-6(11)8-4-7(5-9(12)13)10(8,2)3/h7-8H,4-5H2,1-3H3,(H,12,13)/t7-,8+/m1/s1 |
| InChIKey | SIZDUQQDBXJXLQ-SFYZADRCSA-N |
| SMILES | CC(=O)[C@@H]1C[C@H](CC(O)=O)C1(C)C |
| EPA Substance Registry System | Cyclobutaneacetic acid, 3-acetyl-2,2-dimethyl-, (1R,3R)-rel- (61826-55-9) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HS Code | 29183000 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |