Introduction：Basic information about CAS 4694-12-6|UNII:IRJ0Q2WNHK, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | UNII:IRJ0Q2WNHK |
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| CAS Number | 4694-12-6 | Molecular Weight | 126.196 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 162.8±8.0 °C at 760 mmHg |
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| Molecular Formula | C8H14O | Melting Point | / |
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| MSDS | / | Flash Point | 45.4±10.7 °C |
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Names
| Name | 2,4,4-trimethylcyclopentan-1-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 162.8±8.0 °C at 760 mmHg |
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| Molecular Formula | C8H14O |
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| Molecular Weight | 126.196 |
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| Flash Point | 45.4±10.7 °C |
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| Exact Mass | 126.104462 |
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| PSA | 17.07000 |
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| LogP | 1.72 |
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| Vapour Pressure | 2.1±0.3 mmHg at 25°C |
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| Index of Refraction | 1.432 |
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| InChIKey | OXTQEWUBDTVSFB-UHFFFAOYSA-N |
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| SMILES | CC1CC(C)(C)CC1=O |
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Safety Information
| Risk Phrases | 10 |
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| Safety Phrases | S16 |
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| RIDADR | UN 1224 3/PG 3 |
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| WGK Germany | 3 |
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| Packaging Group | III |
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| Hazard Class | 3 |
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| HS Code | 2914299000 |
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Customs
| HS Code | 2914299000 |
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| Summary | 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| MFCD00019313 |
| Cyclopentanone, 2,4,4-trimethyl- |
| UNII:IRJ0Q2WNHK |
| EINECS 225-155-3 |
| 2,4,4-TRIMETHYLCYCLOPENTANONE |
| Cyclopentanone,2,4,4-trimethyl |
| 2,4,4-Trimethyl-cyclopentanon |
