HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 802452Generated: November 2, 2026
2-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indole-3-carbaldehyde
2-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]indole-3-carbaldehyde · 2-Methyl-1-[2-(4-methyl-piperidin-1-yl)-2-oxo-ethyl]-1H-indole-3-carbaldehyde · 1H-Indole-3-carboxaldehyde, 2-methyl-1-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-
https://huagongshe.com/en/chemical/802452
Identifiers & Physical Properties
| CAS No. | 433955-84-1 |
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| Molecular formula | C18H22N2O2 |
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| Average molar mass | 298.4 g/mol |
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| Monoisotopic mass | 298.16812795 g/mol |
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| SMILES | Cc1c(C=O)c2ccccc2n1CC(=O)N1CCC(C)CC1 |
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| InChIKey | BOKFPTPAAQLKSQ-UHFFFAOYSA-N |
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| PubChem CID | 802452 |
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| DTXSID | DTXSID70355478 |
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Chemical & Physical Properties
| XLogP | 2.8 |
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| Topological polar surface area | 42.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 22 |
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| Formal charge | 0 |
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| Complexity | 417 |
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| Boiling point | 514.1±40.0 °C(Predicted) |
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| Density | 1.18±0.1 g/cm3(Predicted) |
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| pKa (acidity coefficient) | -0.58±0.40(Predicted) |
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| Hazard symbols | Xi |
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| Hazard class | IRRITANT |
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Safety & Regulations
| Hazard symbols | Xi |
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| Hazard class | IRRITANT |
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![2-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indole-3-carbaldehyde molecular structure](/img/chemical/802452.png)