(S)-(+)-5-(Hydroxymethyl)-2-pyrrolidinone p-toluenesulfonate
- Product Name(S)-(+)-5-(Hydroxymethyl)-2-pyrrolidinone p-toluenesulfonate
- CAS51693-17-5
- CBNumberCB6311478
- MFC12H15NO4S
- MW269.32
- MDL NumberMFCD00274229
- MOL File51693-17-5.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 124-128 °C (lit.) |
| alpha | 8.5 º (c=1 in ethanol) |
| Boiling point | 504.8±23.0 °C(Predicted) |
| Density | 1.275±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,2-8°C |
| pka | 15.34±0.40(Predicted) |
| form | Powder |
| color | Colorless to beige |
| optical activity | [α]20/D +8.5°, c = 1 in ethanol |
| InChI | InChI=1S/C12H15NO4S/c1-9-2-5-11(6-3-9)18(15,16)17-8-10-4-7-12(14)13-10/h2-3,5-6,10H,4,7-8H2,1H3,(H,13,14)/t10-/m0/s1 |
| InChIKey | AMZNHHZJURKRFX-JTQLQIEISA-N |
| SMILES | N1[C@H](COS(C2=CC=C(C)C=C2)(=O)=O)CCC1=O |
| UNSPSC Code | 12352005 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HS Code | 29339980 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
