Introduction：Basic information about CAS 136694-18-3|METHYL 3-(3-(TERT-BUTYLTHIO)-1-(4-CHLOROBENZYL)-5-(QUINOLIN-2-YLMETHOXY)-1H-INDOL-2-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | METHYL 3-(3-(TERT-BUTYLTHIO)-1-(4-CHLOROBENZYL)-5-(QUINOLIN-2-YLMETHOXY)-1H-INDOL-2-YL)-2,2-DIMETHYLPROPANOATE |
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| CAS Number | 136694-18-3 | Molecular Weight | 601.198 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 723.8±60.0 °C at 760 mmHg |
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| Molecular Formula | C35H37ClN2O3S | Melting Point | 170-172 °C |
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| MSDS | / | Flash Point | 391.5±32.9 °C |
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Names
| Name | methyl 3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 723.8±60.0 °C at 760 mmHg |
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| Melting Point | 170-172 °C |
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| Molecular Formula | C35H37ClN2O3S |
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| Molecular Weight | 601.198 |
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| Flash Point | 391.5±32.9 °C |
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| Exact Mass | 600.221313 |
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| PSA | 78.65000 |
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| LogP | 8.73 |
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| Vapour Pressure | 0.0±2.3 mmHg at 25°C |
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| Index of Refraction | 1.602 |
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| InChIKey | VFRXMMIRFNYCEH-UHFFFAOYSA-N |
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| SMILES | COC(=O)C(C)(C)Cc1c(SC(C)(C)C)c2cc(OCc3ccc4ccccc4n3)ccc2n1Cc1ccc(Cl)cc1 |
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Synonyms
| Methyl 3-[1-(4-chlorobenzyl)-3-[(2-methyl-2-propanyl)sulfanyl]-5-(2-quinolinylmethoxy)-1H-indol-2-yl]-2,2-dimethylpropanoate |
| 1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-[(1,1-dimethylethyl)thio]-α,α-dimethyl-5-(2-quinolinylmethoxy)-, methyl ester |
