Introduction：Basic information about CAS 99886-53-0|(3S,4R)-METHYL 3-(4-CHLOROBENZOYL)-6-(4-CHLOROPHENYL)-3,4,5-TRIHYDROXY-6-OXOHE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3S,4R)-METHYL 3-(4-CHLOROBENZOYL)-6-(4-CHLOROPHENYL)-3,4,5-TRIHYDROXY-6-OXOHEXANOATE |
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| CAS Number | 99886-53-0 | Molecular Weight | 425.259 |
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| Density | 1.4±0.1 g/cm3 | Boiling Point | 521.0±50.0 °C at 760 mmHg |
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| Molecular Formula | C20H18Cl2O6 | Melting Point | / |
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| MSDS | / | Flash Point | 185.1±29.1 °C |
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Names
| Name | methyl (3S,4R)-3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate |
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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 | 521.0±50.0 °C at 760 mmHg |
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| Molecular Formula | C20H18Cl2O6 |
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| Molecular Weight | 425.259 |
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| Flash Point | 185.1±29.1 °C |
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| Exact Mass | 424.048035 |
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| PSA | 71.06000 |
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| LogP | 5.01 |
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| Vapour Pressure | 0.0±1.4 mmHg at 25°C |
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| Index of Refraction | 1.594 |
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| InChIKey | XYRDGHQDDWNESS-MFUMQWNRSA-N |
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| SMILES | COC(=O)CC(O)(C(=O)c1ccc(Cl)cc1)C(O)C(O)C(=O)c1ccc(Cl)cc1 |
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Synonyms
| Methyl 3,5-bis-O-(4-chlorobenzoyl)-2-deoxy-D-erythro-pentofuranoside |
| X7266 |
| D-erythro-Pentofuranoside, methyl 2-deoxy-, bis(4-chlorobenzoate) |
| (3S,4R)-Methyl 3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate |
