N-(p-Tolylsulphonyl)-L-glutamic acid
- Product NameN-(p-Tolylsulphonyl)-L-glutamic acid
- CAS4816-80-2
- CBNumberCB4179263
- MFC12H15NO6S
- MW301.32
- EINECS225-390-1
- MDL NumberMFCD00020545
- MOL File4816-80-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 122-137°C |
| Boiling point | 534.2±60.0 °C(Predicted) |
| Density | 1.427 |
| refractive index | 1.6280 (estimate) |
| storage temp. | Sealed in dry,Store in freezer, under -20°C |
| solubility | DMSO, Methanol |
| form | Solid |
| pka | 3.27±0.10(Predicted) |
| color | Off-White |
| optical activity | 20.4° (C=1.00 g/100ml, EA) |
| Stability | Hygroscopic |
| InChI | InChI=1S/C12H15NO6S/c1-8-2-4-9(5-3-8)20(18,19)13-10(12(16)17)6-7-11(14)15/h2-5,10,13H,6-7H2,1H3,(H,14,15)(H,16,17)/t10-/m0/s1 |
| InChIKey | KKOZKXBAPIYWAT-JTQLQIEISA-N |
| SMILES | C(O)(=O)[C@H](CCC(O)=O)NS(C1=CC=C(C)C=C1)(=O)=O |
| CAS DataBase Reference | 4816-80-2(CAS DataBase Reference) |
| FDA UNII | 2HXU3N9FF3 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| Safety Statements | 24/25 | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 29350090 | |||||||||
| NFPA 704: |
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