HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 68898772Generated: November 2, 2026
Bromo-3-isopropyl-4-oxo-3,4-dihydro-phthalazine-6-carboxylic acid ethyl ester
https://huagongshe.com/en/chemical/68898772
Identifiers & Physical Properties
| Molecular formula | C14H15BrN2O3 |
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| Average molar mass | 339.18 g/mol |
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| Monoisotopic mass | 338.0266 g/mol |
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| SMILES | CCOC(=O)c1ccc2c(Br)nn(C(C)C)c(=O)c2c1 |
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| InChIKey | CTDGTEXFTXJXDS-UHFFFAOYSA-N |
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| PubChem CID | 68898772 |
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Chemical & Physical Properties
| XLogP | 3 |
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| Topological polar surface area | 59 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 436 |
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