Introduction:Basic information about CAS 4845-99-2|Brucine sulphate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Brucine sulphate |
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| CAS Number | 4845-99-2 | Molecular Weight | 887.006 |
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| Density | 1.41 g/cm3 | Boiling Point | 633.7ºC at 760 mmHg |
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| Molecular Formula | C46H54N4O12S | Melting Point | ~185 °C (dec.)(lit.) |
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| MSDS | / | Flash Point | 337.1ºC |
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Names
| Name | brucine sulfate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.41 g/cm3 |
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| Boiling Point | 633.7ºC at 760 mmHg |
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| Melting Point | ~185 °C (dec.)(lit.) |
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| Molecular Formula | C46H54N4O12S |
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| Molecular Weight | 887.006 |
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| Flash Point | 337.1ºC |
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| Exact Mass | 886.345886 |
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| PSA | 250.07000 |
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| LogP | 4.20310 |
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| InChIKey | HCMSIGALSOEZRW-WIMNQIPBSA-N |
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| SMILES | COc1cc2c(cc1OC)C13CCN4CC5=CCOC6CC(=O)N2C1C6C5CC43.COc1cc2c(cc1OC)C13CCN4CC5=CCOC6CC(=O)N2C1C6C5CC43.O=S(=O)(O)O |
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Safety Information
| Hazard Codes | T+: Very toxic; |
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| Risk Phrases | 26/28-52/53 |
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| Safety Phrases | S13-S45-S61 |
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| RIDADR | UN 1544 6.1/PG 2 |
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| WGK Germany | 3 |
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| Packaging Group | I |
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| Hazard Class | 6.1(a) |
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Synonyms
| BRUCINE SULPHATE |
| 2,3-Dimethoxystrychnidin-10-one sulfate |
| Brucin,Sulfat |
| MFCD00013472 |
| BrucineSulphatePuriss |
| 10,11-DIMETHOXYSTRYCHINE SULFATE SALT |
| BRUCINE SULFATE SALT |
| Strychnidin-10-one, 2,3-dimethoxy-, (13ξ)-, sulfate (2:1) |
| (13ξ)-2,3-Dimethoxystrychnidin-10-one sulfate (2:1) |
| EINECS 225-432-9 |
| brucine,sulfate |
| Dimethoxy strychnine sulfate |
| Brucine Sulfate,Heptahydrate,Reagent |