Introduction：Basic information about CAS 904667-65-8|Daturametelin I, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Daturametelin I |
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| CAS Number | 904667-65-8 | Molecular Weight | 616.739 |
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| Density | 1.4±0.1 g/cm3 | Boiling Point | 828.8±65.0 °C at 760 mmHg |
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| Molecular Formula | C34H48O10 | Melting Point | / |
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| MSDS | / | Flash Point | 261.6±27.8 °C |
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Names
| Name | Daturametelin I |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.4±0.1 g/cm3 |
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| Boiling Point | 828.8±65.0 °C at 760 mmHg |
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| Molecular Formula | C34H48O10 |
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| Molecular Weight | 616.739 |
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| Flash Point | 261.6±27.8 °C |
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| Exact Mass | 616.324768 |
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| PSA | 162.98000 |
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| LogP | 1.56 |
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| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
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| Index of Refraction | 1.615 |
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| InChIKey | ZKPXDCPRHDFPTL-UHFFFAOYSA-N |
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| SMILES | CC1=C(COC2OC(CO)C(O)C(O)C2O)C(=O)OC(C(C)C2CCC3C4C(O)C=C5C=CCC(=O)C5(C)C4CCC23C)C1 |
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Safety Information
Synonyms
| Ergosta-3,5,24-triene-1,26-dione, 22,26-epoxy-27-(β-D-glucopyranosyloxy)-7-hydroxy-, (7α,22R)- |
| (7α,22R)-7-Hydroxy-1,26-dioxo-22,26-epoxyergosta-3,5,24-trien-27-yl β-D-glucopyranoside |
