HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 781638Generated: October 23, 2026
5-(4-Methoxy-2-nitrophenyl)-2-furaldehyde
AKOS BB-7867 · AURORA KA-4228 · ASISCHEM B52553 · AKOS BBS-00006643 · TIMTEC-BB SBB009801 · ART-CHEM-BB B025394 · 5-(4-Methoxy-2-nitrophenyl)-2-furaldehyde · 5-(4-METHOXY-2-NITRO-PHENYL)-FURAN-2-CARBALDEHYDE
https://huagongshe.com/en/chemical/781638
Identifiers & Physical Properties
| CAS No. | 415943-88-3 |
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| Molecular formula | C12H9NO5 |
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| Average molar mass | 247.2 g/mol |
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| Monoisotopic mass | 247.04807239 g/mol |
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| SMILES | COc1ccc(-c2ccc(C=O)o2)c([N+](=O)[O-])c1 |
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| InChIKey | KJPUSAJELIKPIW-UHFFFAOYSA-N |
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| PubChem CID | 781638 |
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| DTXSID | DTXSID90354781 |
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Chemical & Physical Properties
| XLogP | 2.2 |
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| Topological polar surface area | 85.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 18 |
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| Formal charge | 0 |
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| Complexity | 316 |
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| Boiling point | 432.2±45.0 °C(Predicted) |
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| Density | 1.336±0.06 g/cm3(Predicted) |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P261-P305+P351+P338 |
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Safety & Regulations
| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H302-H315-H319-H335 |
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| GHS precautionary statements | P261-P305+P351+P338 |
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