(S)-(+)-Hexahydromandelic acid
- Product Name(S)-(+)-Hexahydromandelic acid
- CAS61475-31-8
- MFC8H14O3
- MW158.2
- EINECS
- MOL File61475-31-8.mol
Chemical Properties
| Melting point | 127-130 °C (lit.) |
| Boiling point | 319.317±15.00 °C(Press: 760.00 Torr)(predicted) |
| Density | 1.179±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| storage temp. | 2-8°C |
| pka | 3.864±0.11(predicted) |
| Appearance | White to off-white Solid |
| optical activity | [α]18/D +23°, c = 1 in acetic acid |
| BRN | 4663647 |
| InChI | 1S/C8H14O3/c9-7(8(10)11)6-4-2-1-3-5-6/h6-7,9H,1-5H2,(H,10,11)/t7-/m0/s1 |
| InChIKey | RRDPWAPIJGSANI-ZETCQYMHSA-N |
| SMILES | O[C@@H](C1CCCCC1)C(O)=O |
Safety Information
| Safety Statements | 22-24/25 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |