Introduction：Basic information about CAS 2161-40-2|alpha-Methoxytropone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | alpha-Methoxytropone |
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| CAS Number | 2161-40-2 | Molecular Weight | 136.14800 |
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| Density | 1.08g/cm3 | Boiling Point | 287ºC at 760 mmHg |
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| Molecular Formula | C8H8O2 | Melting Point | 132 °C |
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| MSDS | / | Flash Point | 141.4ºC |
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Names
| Name | 2-methoxycyclohepta-2,4,6-trien-1-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.08g/cm3 |
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| Boiling Point | 287ºC at 760 mmHg |
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| Melting Point | 132 °C |
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| Molecular Formula | C8H8O2 |
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| Molecular Weight | 136.14800 |
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| Flash Point | 141.4ºC |
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| Exact Mass | 136.05200 |
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| PSA | 26.30000 |
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| LogP | 1.05540 |
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| Vapour Pressure | 0.00255mmHg at 25°C |
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| Index of Refraction | 1.524 |
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| InChIKey | IQYJSKNHDZZDGA-UHFFFAOYSA-N |
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| SMILES | COc1cccccc1=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GU4606000
- CHEMICAL NAME :
- 2,4,6-Cycloheptatrien-1-one, 2-methoxy-
- CAS REGISTRY NUMBER :
- 2161-40-2
- BEILSTEIN REFERENCE NO. :
- 2041321
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C8-H8-O2
- MOLECULAR WEIGHT :
- 136.16
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 176 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 92,19,1972
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Safety Information
Customs
| HS Code | 2914509090 |
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| Summary | HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
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Synonyms
| 2-Methoxytropone |
| 2-C-Methoxytropone |
| 2-methoxy-cycloheptatrienone |
| 2-methoxy-2,4,6-cycloheptatrien-1-one |
| 2-Methoxytropolone |
| 2-methoxy-cyclohepta-2,4,6-trienone |
| Tropolone methyl ether |
| 2,4,6-CYCLOHEPTATRIEN-1-ONE,2-METHOXY |
