Introduction：Basic information about CAS 20850-49-1|UNII:1Z42YUG42K, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | UNII:1Z42YUG42K |
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| CAS Number | 20850-49-1 | Molecular Weight | 219.280 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 327.3±37.0 °C at 760 mmHg |
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| Molecular Formula | C13H17NO2 | Melting Point | 46-49ºC |
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| MSDS | / | Flash Point | 114.5±19.7 °C |
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Names
| Name | 2-(3,4-Dimethoxyphenyl)-3-methylbutanenitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 327.3±37.0 °C at 760 mmHg |
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| Melting Point | 46-49ºC |
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| Molecular Formula | C13H17NO2 |
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| Molecular Weight | 219.280 |
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| Flash Point | 114.5±19.7 °C |
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| Exact Mass | 219.125931 |
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| PSA | 42.25000 |
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| LogP | 2.41 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.499 |
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| InChIKey | NFXAXMOAVPLEBH-UHFFFAOYSA-N |
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| SMILES | COc1ccc(C(C#N)C(C)C)cc1OC |
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| Storage condition | -20°C Freezer |
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Safety Information
Customs
| HS Code | 2926909090 |
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| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| EINECS 244-082-8 |
| Benzeneacetonitrile, 3,4-dimethoxy-α-(1-methylethyl)- |
| 2-(3,4-Dimethoxyphenyl)-3-methylbutanenitrile |
| 2-(3,4-Dimethoxy pheny)-3-methylbutyronitrile |
| UNII:1Z42YUG42K |
| MFCD00800230 |
