4-hydroxy-3,5-dimethyl-benzenecarbonitrile
- Product Name4-hydroxy-3,5-dimethyl-benzenecarbonitrile
- CAS4198-90-7
- CBNumberCB1151790
- MFC9H9NO
- MW147.17
- EINECS452-810-2
- MDL NumberMFCD00221716
- MOL File4198-90-7.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 123-127 °C |
| Boiling point | 267.28°C (rough estimate) |
| Density | 1.1135 (rough estimate) |
| vapor pressure | 0.005Pa at 25℃ |
| refractive index | 1.5290 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | soluble in Methanol |
| pka | pK1:8.27 (25°C) |
| form | Crystalline Powder |
| color | White to beige |
| Water Solubility | 320mg/L at 20℃ |
| InChIKey | WFYGXOWFEIOHCZ-UHFFFAOYSA-N |
| LogP | 1.6 at 20℃ |
| CAS DataBase Reference | 4198-90-7(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | FP7F5WF7R4 |
Safety
| Symbol(GHS) |
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| Signal word | Danger | |||||||||
| Hazard statements | H300-H319 | |||||||||
| Precautionary statements | P264-P270-P280-P301+P310-P305+P351+P338-P337+P313 | |||||||||
| Hazard Codes | T,Xn,Xi | |||||||||
| Risk Statements | 25-36-32-20/21/22-36/37/38 | |||||||||
| Safety Statements | 26-45-36/37 | |||||||||
| RIDADR | UN 2811 6.1/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | DI4359000 | |||||||||
| Hazard Note | Toxic | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29269095 | |||||||||
| Toxicity | mouse,LD50,intraperitoneal,650mg/kg (650mg/kg),Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 201, 1960. | |||||||||
| NFPA 704: |
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