Introduction：Basic information about CAS 81606-79-3|1H-1,2,4-Triazol-1-ylacetonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1H-1,2,4-Triazol-1-ylacetonitrile |
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| CAS Number | 81606-79-3 | Molecular Weight | 108.101 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 312.9±44.0 °C at 760 mmHg |
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| Molecular Formula | C4H4N4 | Melting Point | 55-58ºC |
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| MSDS | / | Flash Point | 143.0±28.4 °C |
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Names
| Name | 2-(1H-1,2,4-Triazol-1-yl)acetonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 312.9±44.0 °C at 760 mmHg |
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| Melting Point | 55-58ºC |
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| Molecular Formula | C4H4N4 |
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| Molecular Weight | 108.101 |
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| Flash Point | 143.0±28.4 °C |
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| Exact Mass | 108.043594 |
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| PSA | 54.50000 |
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| LogP | -1.38 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.634 |
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| InChIKey | ZEDZBEBBGBQWBP-UHFFFAOYSA-N |
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| SMILES | N#CCn1cncn1 |
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Safety Information
| Hazard Codes | Xi |
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| RIDADR | UN 3439 |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 1H-1,2,4-Triazol-1-ylacetonitrile |
| 1H-1,2,4-Triazole-1-acetonitrile |
| 2-(1,2,4-triazol-1-yl)acetonitrile |
