Introduction:Basic information about CAS 75490-39-0|grapefruit nitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | grapefruit nitrile |
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| CAS Number | 75490-39-0 | Molecular Weight | 187.28100 |
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| Density | 0.941g/cm3 | Boiling Point | 294.5ºC at 760 mmHg |
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| Molecular Formula | C13H17N | Melting Point | / |
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| MSDS | / | Flash Point | 134.7ºC |
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Names
| Name | 2,2-dimethyl-4-phenylpentanenitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.941g/cm3 |
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| Boiling Point | 294.5ºC at 760 mmHg |
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| Molecular Formula | C13H17N |
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| Molecular Weight | 187.28100 |
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| Flash Point | 134.7ºC |
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| Exact Mass | 187.13600 |
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| PSA | 23.79000 |
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| LogP | 3.72998 |
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| Index of Refraction | 1.503 |
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| InChIKey | GWCCFAFCQHECBM-UHFFFAOYSA-N |
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| SMILES | CC(CC(C)(C)C#N)c1ccccc1 |
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Safety Information
| Hazard Codes | Xn: Harmful;N: Dangerous for the environment; |
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| Risk Phrases | 22-51/53 |
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| Safety Phrases | 61 |
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Synonyms
| 2,2-dimethyl-4-phenyl-valeronitrile |