HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 23589051Generated: October 27, 2026
4-Chloro-3-cyanomethyl-indole-1-carboxylic acid methylamide
https://huagongshe.com/en/chemical/23589051
Identifiers & Physical Properties
| Molecular formula | C12H10ClN3O |
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| Average molar mass | 247.68 g/mol |
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| Monoisotopic mass | 247.0512396 g/mol |
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| SMILES | CNC(=O)n1cc(CC#N)c2c(Cl)cccc21 |
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| InChIKey | VBFOQESHWUPBIM-UHFFFAOYSA-N |
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| PubChem CID | 23589051 |
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Chemical & Physical Properties
| XLogP | 2 |
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| Topological polar surface area | 57.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 1 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 351 |
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