Introduction:Basic information about CAS 5098-16-8|3-aminobenzotrifluoride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-aminobenzotrifluoride |
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| CAS Number | 5098-16-8 | Molecular Weight | 123.11300 |
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| Density | 1.29 g/mL at 25ºC(lit.) | Boiling Point | 187ºC(lit.) |
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| Molecular Formula | C5H5N3O | Melting Point | 5-6ºC(lit.) |
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| MSDS | / | Flash Point | 185 °F |
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Names
| Name | 5-Amino-2-methyloxazole-4-carbonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.29 g/mL at 25ºC(lit.) |
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| Boiling Point | 187ºC(lit.) |
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| Melting Point | 5-6ºC(lit.) |
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| Molecular Formula | C5H5N3O |
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| Molecular Weight | 123.11300 |
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| Flash Point | 185 °F |
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| Exact Mass | 123.04300 |
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| PSA | 75.84000 |
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| LogP | 1.01808 |
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| Vapour Pressure | 0.3 mm Hg ( 20 °C) |
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| Index of Refraction | n20/D 1.480(lit.) |
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| InChIKey | OVIXKBXQNCJGDG-UHFFFAOYSA-N |
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| SMILES | Cc1nc(C#N)c(N)o1 |
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| Storage condition | 2-8°C |
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Safety Information
| Hazard Codes | T+ |
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| Risk Phrases | 22-24-26-33 |
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| Safety Phrases | 36/37/39-45 |
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| RIDADR | UN 2948 6.1/PG 2 |
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| WGK Germany | 2 |
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| RTECS | XU9180000 |
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| HS Code | 2934999090 |
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Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| MFCD00007797 |
| 5-amino-2-methyl-1,3-oxazole-4-carbonitrile |
| EINECS 202-643-4 |