Introduction：Basic information about CAS 872091-00-4|3-(2-Cyanopropan-2-yl)benzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(2-Cyanopropan-2-yl)benzoic acid |
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| CAS Number | 872091-00-4 | Molecular Weight | 189.210 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 360.0±25.0 °C at 760 mmHg |
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| Molecular Formula | C11H11NO2 | Melting Point | / |
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| MSDS | / | Flash Point | 171.5±23.2 °C |
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Names
| Name | 3-(2-cyanopropan-2-yl)benzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 360.0±25.0 °C at 760 mmHg |
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| Molecular Formula | C11H11NO2 |
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| Molecular Weight | 189.210 |
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| Flash Point | 171.5±23.2 °C |
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| Exact Mass | 189.078979 |
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| PSA | 61.09000 |
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| LogP | 1.82 |
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| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
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| Index of Refraction | 1.548 |
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| InChIKey | VSCTXXVTZNQKAX-UHFFFAOYSA-N |
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| SMILES | CC(C)(C#N)c1cccc(C(=O)O)c1 |
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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
| Benzoic acid, 3-(1-cyano-1-methylethyl)- |
| rw4126 |
| 3-(2-Cyano-2-propanyl)benzoic acid |
| qc-3664 |
