Introduction：Basic information about CAS 3041-16-5|1,4-Dioxan-2-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,4-Dioxan-2-one |
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| CAS Number | 3041-16-5 | Molecular Weight | 102.089 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 222.9±23.0 °C at 760 mmHg |
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| Molecular Formula | C4H6O3 | Melting Point | 28°C(lit.) |
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| MSDS | / | Flash Point | 85.5±17.2 °C |
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Names
| Name | 1,4-Dioxan-2-one |
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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 | 222.9±23.0 °C at 760 mmHg |
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| Melting Point | 28°C(lit.) |
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| Molecular Formula | C4H6O3 |
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| Molecular Weight | 102.089 |
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| Flash Point | 85.5±17.2 °C |
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| Exact Mass | 102.031693 |
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| PSA | 35.53000 |
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| LogP | -1.54 |
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| Vapour Pressure | 0.1±0.4 mmHg at 25°C |
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| Index of Refraction | 1.426 |
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| InChIKey | VPVXHAANQNHFSF-UHFFFAOYSA-N |
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| SMILES | O=C1COCCO1 |
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| Storage condition | 2-8°C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- JH2290000
- CHEMICAL NAME :
- p-Dioxan-2-one
- CAS REGISTRY NUMBER :
- 3041-16-5
- BEILSTEIN REFERENCE NO. :
- 0383602
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C4-H6-O3
- MOLECULAR WEIGHT :
- 102.10
- WISWESSER LINE NOTATION :
- T6OV DOTJ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 790 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 38,1621,1978
- TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,213,1954
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2932209090 |
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Customs
| HS Code | 2932209090 |
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| Summary | 2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| [1,4]dioxan-2-one |
| 2-p-dioxanone |
| 1,4-dioxanone |
| 1,4-Dioxan-2-one (9CI) |
| 4-dioxanone |
| para-Dioxanone |
| 2-Oxo-1,4-dioxane |
| 1,4-Dioxan-2-one |
| PARA-DIOXANE-2-ONE |
| p-dioxanone |
| p-Dioxan-2-one |
| 1,4-dioxane-2-one |
