Introduction：Basic information about CAS 111291-97-5|tert-butyl 4-ethynylbenzoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | tert-butyl 4-ethynylbenzoate |
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| CAS Number | 111291-97-5 | Molecular Weight | 202.24900 |
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| Density | 1.046g/cm3 | Boiling Point | 279.525ºC at 760 mmHg |
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| Molecular Formula | C13H14O2 | Melting Point | / |
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| MSDS | / | Flash Point | 112.148ºC |
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Names
| Name | tert-butyl 4-ethynylbenzoate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.046g/cm3 |
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| Boiling Point | 279.525ºC at 760 mmHg |
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| Molecular Formula | C13H14O2 |
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| Molecular Weight | 202.24900 |
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| Flash Point | 112.148ºC |
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| Exact Mass | 202.09900 |
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| PSA | 26.30000 |
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| LogP | 2.62320 |
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| Vapour Pressure | 0.004mmHg at 25°C |
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| Index of Refraction | 1.52 |
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| InChIKey | FWAUARVBLKIMRS-UHFFFAOYSA-N |
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| SMILES | C#Cc1ccc(C(=O)OC(C)(C)C)cc1 |
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| Storage condition | 2-8°C |
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Safety Information
Synonyms
| 4-Ethynyl-Benzoic Acid 1,1-Dimethylethyl Ester |
| t-butyl 4-ethynylbenzoate |
| AB2737 |
| 4-ethynylbenzoic acid tert-butyl ester |
| tert-butyl 4-ethynyl benzoate |
| Benzoic acid,4-ethynyl-,1,1-dimethylethyl ester |
