3,6-Dihydroxyphthalonitrile
- Product Name3,6-Dihydroxyphthalonitrile
- CAS4733-50-0
- CBNumberCB9480674
- MFC8H4N2O2
- MW160.13
- EINECS225-241-0
- MDL NumberMFCD00001790
- MOL File4733-50-0.mol
- MSDS FileSDS
Chemical Properties
| Melting point | >230 °C (dec.) (lit.) |
| Boiling point | 286.01°C (rough estimate) |
| Density | 1.3848 (rough estimate) |
| refractive index | 1.4900 (estimate) |
| storage temp. | Store below +30°C. |
| form | Crystalline Powder or Needles |
| pka | 6.21±0.23(Predicted) |
| color | Khaki to brown |
| Water Solubility | Soluble in hot water |
| BRN | 2101249 |
| InChI | InChI=1S/C8H4N2O2/c9-3-5-6(4-10)8(12)2-1-7(5)11/h1-2,11-12H |
| InChIKey | MPAIWVOBMLSHQA-UHFFFAOYSA-N |
| SMILES | C1(C#N)=C(O)C=CC(O)=C1C#N |
| CAS DataBase Reference | 4733-50-0(CAS DataBase Reference) |
| FDA UNII | TTR9Y6YSS8 |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319 | |||||||||
| Precautionary statements | P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313 | |||||||||
| Hazard Codes | Xi,Xn | |||||||||
| Risk Statements | 36/37/38-20/21/22 | |||||||||
| Safety Statements | 26-37/39-36/37/39 | |||||||||
| RIDADR | UN 2811 6.1/PG III | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29269090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 | |||||||||
| NFPA 704: |
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