(+)-3-Methylhexanedioic acid
- Product Name(+)-3-Methylhexanedioic acid
- CAS623-82-5
- MFC7H12O4
- MW160.17
- EINECS210-816-0
- MOL File623-82-5.mol
Chemical Properties
| Melting point | 81-84 °C(lit.) |
| Boiling point | 230 °C30 mm Hg(lit.) |
| Density | 1.3681 (rough estimate) |
| refractive index | 1.4336 (estimate) |
| storage temp. | 2-8°C |
| pka | 4.66±0.10(Predicted) |
| Appearance | White to off-white Solid |
| optical activity | [α]21/D +7.2°, c = 5 in methanol |
| BRN | 4661826 |
| InChI | 1S/C7H12O4/c1-5(4-7(10)11)2-3-6(8)9/h5H,2-4H2,1H3,(H,8,9)(H,10,11)/t5-/m1/s1 |
| InChIKey | SYEOWUNSTUDKGM-RXMQYKEDSA-N |
| SMILES | C[C@H](CCC(O)=O)CC(O)=O |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2917198090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
