5-(4-Methoxy-phenyl)-cyclohexane-1,3-dione
- Product Name5-(4-Methoxy-phenyl)-cyclohexane-1,3-dione
- CAS1774-12-5
- CBNumberCB4131083
- MFC13H14O3
- MW218.25
- MDL NumberMFCD00104791
- MOL File1774-12-5.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 179.5-183.5 °C(lit.) |
| Boiling point | 394.4±42.0 °C(Predicted) |
| Density | 1.163±0.06 g/cm3(Predicted) |
| storage temp. | Storage temp. 2-8°C |
| pka | 4.95±0.20(Predicted) |
| Appearance | White to light yellow Solid |
| InChI | 1S/C13H14O3/c1-16-13-4-2-9(3-5-13)10-6-11(14)8-12(15)7-10/h2-5,10H,6-8H2,1H3 |
| InChIKey | AHYCBDWPHFFKFK-UHFFFAOYSA-N |
| SMILES | COc1ccc(cc1)C2CC(=O)CC(=O)C2 |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
 
|
| Signal word | Warning |
| Hazard statements | H302-H315-H319-H226 |
| Precautionary statements | P501-P270-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P403+P235 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2914500090 |
| Storage Class | 11 - Combustible Solids |
