Introduction：Basic information about CAS 95-41-0|2-Hexyl-2-cyclopenten-1-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Hexyl-2-cyclopenten-1-one |
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| CAS Number | 95-41-0 | Molecular Weight | 166.260 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 255.8±10.0 °C at 760 mmHg |
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| Molecular Formula | C11H18O | Melting Point | / |
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| MSDS | / | Flash Point | 107.7±9.8 °C |
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Names
| Name | 2-hexylcyclopent-2-en-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 | 255.8±10.0 °C at 760 mmHg |
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| Molecular Formula | C11H18O |
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| Molecular Weight | 166.260 |
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| Flash Point | 107.7±9.8 °C |
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| Exact Mass | 166.135757 |
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| PSA | 17.07000 |
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| LogP | 3.19 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.474 |
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| InChIKey | VGECIEOJXLMWGO-UHFFFAOYSA-N |
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| SMILES | CCCCCCC1=CCCC1=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GY7290000
- CHEMICAL NAME :
- 2-Cyclopenten-1-one, 2-hexyl-
- CAS REGISTRY NUMBER :
- 95-41-0
- BEILSTEIN REFERENCE NO. :
- 1931570
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C11-H18-O
- MOLECULAR WEIGHT :
- 166.29
- WISWESSER LINE NOTATION :
- L5V BUTJ B6
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 16,713,1978 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 320 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00920
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Safety Information
| Hazard Codes | Xn |
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| Risk Phrases | 22 |
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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
| EINECS 202-417-5 |
| 2-hexylcyclopent-2-enone |
| 2-Hexyl-2-cyclopenten-1-one |
| 2-Cyclopenten-1-one,2-hexyl |
| 2-n-Hexyl-2-cyclopenten-1-one |
| 2-Cyclopenten-1-one, 2-hexyl- |
| isojasmone B11 |
| 2-n-hexyl-2-cyclopentenone |
| Dihydroisojasmone |
| 2-hexylcyclopent-2-en-1-one |
| 2-Hexyl-2-cyclopentenone |
