HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 123789179Generated: November 2, 2026
Tert-butyl (2-{[4-(benzyloxy)-2-nitrophenyl]amino}-1-methyl-2-oxoethyl)carbamate
https://huagongshe.com/en/chemical/123789179
Identifiers & Physical Properties
| Molecular formula | C21H25N3O6 |
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| Average molar mass | 415.4 g/mol |
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| Monoisotopic mass | 415.17433553 g/mol |
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| SMILES | CC(NC(=O)OC(C)(C)C)C(=O)Nc1ccc(OCc2ccccc2)cc1[N+](=O)[O-] |
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| InChIKey | GQWJKMDDUOZKBW-UHFFFAOYSA-N |
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| PubChem CID | 123789179 |
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Chemical & Physical Properties
| XLogP | 4.1 |
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| Topological polar surface area | 122 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 8 |
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| Heavy atoms | 30 |
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| Formal charge | 0 |
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| Complexity | 595 |
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![Tert-butyl (2-{[4-(benzyloxy)-2-nitrophenyl]amino}-1-methyl-2-oxoethyl)carbamate molecular structure](/img/chemical/123789179.png)