7-Hydroxy-5-methyl-1,3,4-triazaindolizine
- Product Name7-Hydroxy-5-methyl-1,3,4-triazaindolizine
- CAS2503-56-2
- MFC6H6N4O
- MW150.14
- EINECS219-706-7
- MOL File2503-56-2.mol
Chemical Properties
| Melting point | 280-283 °C(lit.) |
| Boiling point | 271.66°C (rough estimate) |
| Density | 1.3471 (rough estimate) |
| vapor pressure | 0-0Pa at 20-25℃ |
| refractive index | 1.6700 (estimate) |
| storage temp. | 2-8°C |
| pka | 1.14±0.53(Predicted) |
| form | solid |
| color | White to Almost white |
| Water Solubility | INSOLUBLE IN COLD WATER |
| BRN | 609440 |
| InChI | 1S/C6H6N4O/c1-4-2-5(11)10-6(9-4)7-3-8-10/h2-3,11H,1H3 |
| InChIKey | ZUIVNYGZFPOXFW-UHFFFAOYSA-N |
| SMILES | Cc1cc(O)n2ncnc2n1 |
| LogP | -1.4 at 19℃ and pH7.1 |
| CAS DataBase Reference | 2503-56-2(CAS DataBase Reference) |
| NIST Chemistry Reference | Pyrimidin-7-ol, 5-methyl-s-triazolo-[1,5-a]-(2503-56-2) |
| EPA Substance Registry System | [1,2,4]Triazolo[1,5-a]pyrimidin-7-ol, 5-methyl- (2503-56-2) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-37/39 |
| WGK Germany | 1 |
| RTECS | XZ6133300 |
| F | 9 |
| Hazard Note | Harmful |
| TSCA | TSCA listed |
| HS Code | 2933998090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Toxicity | mouse,LD50,intravenous,> 450mg/kg (450mg/kg),Oyo Yakuri. Pharmacometrics. Vol. 13, Pg. 597, 1977. |
