Introduction:Basic information about CAS 52188-12-2|2-(7,9,9-trioxo-9$l^{6}-thia-8-azabicyclo[4.3.0]nona-1,3,5-trien-8-yl)acetonit, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(7,9,9-trioxo-9$l^{6}-thia-8-azabicyclo[4.3.0]nona-1,3,5-trien-8-yl)acetonitrile |
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| CAS Number | 52188-12-2 | Molecular Weight | 222.22100 |
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| Density | 1.547g/cm3 | Boiling Point | 462.2ºC at 760 mmHg |
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| Molecular Formula | C9H6N2O3S | Melting Point | 142ºC |
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| MSDS | / | Flash Point | 233.3ºC |
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Names
| Name | 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.547g/cm3 |
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| Boiling Point | 462.2ºC at 760 mmHg |
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| Melting Point | 142ºC |
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| Molecular Formula | C9H6N2O3S |
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| Molecular Weight | 222.22100 |
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| Flash Point | 233.3ºC |
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| Exact Mass | 222.01000 |
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| PSA | 86.62000 |
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| LogP | 1.37338 |
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| Index of Refraction | 1.633 |
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| InChIKey | XOOUGZKBOROESV-UHFFFAOYSA-N |
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| SMILES | N#CCN1C(=O)c2ccccc2S1(=O)=O |
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Safety Information
| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R20/21/22 |
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| Safety Phrases | S36/37 |
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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
| 3-oxo-1,2-benzoisothiazoline-2-acetonitrile 1,1-dioxide |
| saccharin-2-acetonitrile |