(2S)-4-(1,3-Dioxoisoindolin-2-yl)-2-hydroxybutanoic acid
- Product Name(2S)-4-(1,3-Dioxoisoindolin-2-yl)-2-hydroxybutanoic acid
- CAS48172-10-7
- CBNumberCB6853666
- MFC12H11NO5
- MW249.22
- MDL NumberMFCD00192213
- MOL File48172-10-7.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 157-159 °C(lit.) |
| Boiling point | 392.32°C (rough estimate) |
| Density | 1.3189 (rough estimate) |
| refractive index | 6 ° (C=1, MeOH) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | almost transparency in Methanol |
| form | powder to crystal |
| pka | 3.67±0.10(Predicted) |
| color | White to Almost white |
| optical activity | [α]20/D +6.5°, c =1 in ethanol |
| InChI | 1S/C12H11NO5/c14-9(12(17)18)5-6-13-10(15)7-3-1-2-4-8(7)11(13)16/h1-4,9,14H,5-6H2,(H,17,18)/t9-/m0/s1 |
| InChIKey | YWDXODQRCDEZLN-VIFPVBQESA-N |
| SMILES | O[C@@H](CCN1C(=O)c2ccccc2C1=O)C(O)=O |
| CAS DataBase Reference | 48172-10-7(CAS DataBase Reference) |
| UNSPSC Code | 12352005 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-37/39 |
| WGK Germany | 3 |
| HS Code | 29335995 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
