Introduction:Basic information about CAS 1125-12-8|Bicyclo[3.1.0]hexan-3-one,4-methyl-1-(1-methylethyl)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Bicyclo[3.1.0]hexan-3-one,4-methyl-1-(1-methylethyl)- |
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| CAS Number | 1125-12-8 | Molecular Weight | 152.23300 |
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| Density | 1.009g/cm3 | Boiling Point | 200.5ºC at 760mmHg |
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| Molecular Formula | C10H16O | Melting Point | / |
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| MSDS | / | Flash Point | 64.4ºC |
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Names
| Name | thujone |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.009g/cm3 |
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| Boiling Point | 200.5ºC at 760mmHg |
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| Molecular Formula | C10H16O |
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| Molecular Weight | 152.23300 |
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| Flash Point | 64.4ºC |
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| Exact Mass | 152.12000 |
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| PSA | 17.07000 |
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| LogP | 2.25760 |
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| Index of Refraction | n20/D 1.455(lit.) |
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| InChIKey | USMNOWBWPHYOEA-UHFFFAOYSA-N |
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| SMILES | CC1C(=O)CC2(C(C)C)CC12 |
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Safety Information
| Hazard Codes | T: Toxic; |
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| Risk Phrases | 23/24/25-36/37/38-42/43 |
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| Safety Phrases | 23-26-36/37/39-45 |
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| RIDADR | UN 2810 6.1/PG 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
| Bicyclo[3.1.0]hexan-3-one,4-methyl-1-(1-methylethyl) |
| 1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-one |
| 5-isopropyl-2-methyl-bicyclo[3.1.0]hex-3-one |
| EINECS 214-405-7 |
| 4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one |
| 4-methyl-1-(1-methylethyl)-bicyclo[3.1.0]hexan-3-on |
| Thujone |
| MFCD00135597 |
| (1S,4R)-thujan-3-one |