4-Methyl-2-(3-pyridinyl)-1,3-thiazole-5-carboxylic acid
- Product Name4-Methyl-2-(3-pyridinyl)-1,3-thiazole-5-carboxylic acid
- CAS39091-01-5
- MFC10H8N2O2S
- MW220.25
- EINECS
- MOL File39091-01-5.mol
Chemical Properties
| Melting point | 244-248 °C (dec.)(lit.) |
| Boiling point | 459.0±55.0 °C(Predicted) |
| Density | 1.381±0.06 g/cm3(Predicted) |
| solubility | DMF: 1.5 mg/ml; DMSO: 2 mg/ml; DMSO:PBS(pH7.2) (1:1): 0.5 mg/ml |
| form | A crystalline solid |
| pka | 1.71±0.37(Predicted) |
| InChI | 1S/C10H8N2O2S/c1-6-8(10(13)14)15-9(12-6)7-3-2-4-11-5-7/h2-5H,1H3,(H,13,14) |
| InChIKey | CJLQNROYBZEUGH-UHFFFAOYSA-N |
| SMILES | Cc1nc(sc1C(O)=O)-c2cccnc2 |
| CAS DataBase Reference | 39091-01-5(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2934100090 |
| Storage Class | 13 - Non Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |