HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 136259172Generated: November 3, 2026
2-(3-Chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-iodo-2,3-dihydroquinazolin-4(1H)-one
https://huagongshe.com/en/chemical/136259172
Identifiers & Physical Properties
| CAS No. | 920275-65-6 |
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| Molecular formula | C14H8ClIN2O2 |
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| Average molar mass | 398.58 g/mol |
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| Monoisotopic mass | 397.9319 g/mol |
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| SMILES | O=c1[nH]c(-c2cc(Cl)ccc2O)nc2ccc(I)cc12 |
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| InChIKey | YKUWEBOLBFABEK-UHFFFAOYSA-N |
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| PubChem CID | 136259172 |
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| DTXSID | DTXSID10841764 |
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Chemical & Physical Properties
| XLogP | 3.3 |
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| Topological polar surface area | 61.7 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 1 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 431 |
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