890090-65-0
| Name | 6-CHLOROCHROMONE-3-PROPIONIC ACID |
| CAS | 890090-65-0 |
| Molecular Formula | C12H9ClO4 |
| MDL Number | MFCD08276791 |
| Molecular Weight | 252.65 |
| MOL File | 890090-65-0.mol |
Chemical Properties
| Melting point | 178-182 °C |
| Boiling point | 444.3±45.0 °C(Predicted) |
| density | 1.437±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 4.35±0.10(Predicted) |
| InChI | 1S/C12H9ClO4/c13-8-2-3-10-9(5-8)12(16)7(6-17-10)1-4-11(14)15/h2-3,5-6H,1,4H2,(H,14,15) |
| InChIKey | YXTVVBLJYNPMJZ-UHFFFAOYSA-N |
| SMILES | OC(=O)CCC1=COc2ccc(Cl)cc2C1=O |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |