5-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid
- Product Name5-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid
- CAS61727-33-1
- CBNumberCB9335251
- MFC6H5ClN2O2S
- MW204.63
- EINECS626-210-8
- MDL NumberMFCD00173907
- MOL File61727-33-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 165 °C (dec.) |
| Boiling point | 396.4±22.0 °C(Predicted) |
| Density | 1.59±0.1 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| form | powder to crystal |
| pka | 1.20±0.25(Predicted) |
| color | Light yellow to Yellow to Orange |
| InChI | InChI=1S/C6H5ClN2O2S/c1-12-6-8-2-3(7)4(9-6)5(10)11/h2H,1H3,(H,10,11) |
| InChIKey | SEPCYCDQJZTPHO-UHFFFAOYSA-N |
| SMILES | C1(SC)=NC=C(Cl)C(C(O)=O)=N1 |
| CAS DataBase Reference | 61727-33-1(CAS DataBase Reference) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36-37/38-36/37/38 | |||||||||
| Safety Statements | 26-36/37-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Irritant | |||||||||
| HS Code | 2933599590 | |||||||||
| NFPA 704: |
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