4-HYDROXY-3-METHOXYPHENYLACETONITRILE
- Product Name4-HYDROXY-3-METHOXYPHENYLACETONITRILE
- CAS4468-59-1
- CBNumberCB8225898
- MFC9H9NO2
- MW163.17
- EINECS224-739-5
- MDL NumberMFCD00001920
- MOL File4468-59-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 56-57 °C (lit.) |
| Boiling point | 135-145 °C/2 mmHg (lit.) |
| Density | 1.2021 (rough estimate) |
| refractive index | 1.5270 (estimate) |
| pka | 9.69±0.18(Predicted) |
| form | powder |
| color | Off-white |
| InChI | 1S/C9H9NO2/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,11H,4H2,1H3 |
| InChIKey | SDVYWMWQCJEYTC-UHFFFAOYSA-N |
| SMILES | COc1cc(CC#N)ccc1O |
| CAS DataBase Reference | 4468-59-1(CAS DataBase Reference) |
| FDA UNII | KBJ5T7NP94 |
| UNSPSC Code | 12352100 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302+H312+H332-H315-H319-H335 |
| Precautionary statements | P261-P280-P305+P351+P338 |
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-37/39 |
| RIDADR | UN3439 |
| WGK Germany | 3 |
| HazardClass | IRRITANT-HARMFUL |
| HS Code | 2926907090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
