3H-Indole-3-aceticacid, a-hydroxy-2-(methoxycarbonyl)-,methyl ester, 1-oxide
Modify Date: 2025-11-25 09:37:08
3H-Indole-3-aceticacid, a-hydroxy-2-(methoxycarbonyl)-,methyl ester, 1-oxide structure
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Common Name | 3H-Indole-3-aceticacid, a-hydroxy-2-(methoxycarbonyl)-,methyl ester, 1-oxide | ||
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| CAS Number | 74640-77-0 | Molecular Weight | 279.24500 | |
| Density | 1.4g/cm3 | Boiling Point | 440.7ºC at 760mmHg | |
| Molecular Formula | C13H13NO6 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 220.4ºC | |
| Name | methyl 3-(1-hydroxy-2-methoxy-2-oxoethyl)-1-oxido-3H-indol-1-ium-2-carboxylate |
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| Synonym | More Synonyms |
| Density | 1.4g/cm3 |
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| Boiling Point | 440.7ºC at 760mmHg |
| Molecular Formula | C13H13NO6 |
| Molecular Weight | 279.24500 |
| Flash Point | 220.4ºC |
| Exact Mass | 279.07400 |
| PSA | 101.58000 |
| LogP | 0.03230 |
| Index of Refraction | 1.595 |
| InChIKey | CAIXDWSEGYEVLC-UHFFFAOYSA-N |
| SMILES | COC(=O)C1=[N+]([O-])c2ccccc2C1C(O)C(=O)OC |
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~83%
3H-Indole-3-ace... CAS#:74640-77-0 |
| Literature: Takahashi, Kiyobumi; Kaji, Eisuke; Zen, Shonosuke Heterocycles, 1984 , vol. 21, # 2 p. 736 |
| Precursor 1 | |
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| DownStream 0 | |
| 3-(hydroxy-methoxycarbonyl-methyl)-1-oxy-3H-indole-2-carboxylic acid methyl ester |