HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 727559Generated: October 23, 2026
5-(1,3-Benzothiazol-2-yl)furan-2-carbaldehyde
5-(2-benzothiazolyl)-2-Furancarboxaldehyde · 2-Furancarboxaldehyde,5-(2-benzothiazolyl)- · 5-(Benzo[d]thiazol-2-yl)-2-furancarbaldehyde · 5-(Benzo[d]thiazol-2-yl)furan-2-carbaldehyde · 5-(1,3-benzothiazol-2-yl)furan-2-carbaldehyde
https://huagongshe.com/en/chemical/727559
Identifiers & Physical Properties
| CAS No. | 34653-56-0 |
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| Molecular formula | C12H7NO2S |
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| Average molar mass | 229.26 g/mol |
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| Monoisotopic mass | 229.01974946 g/mol |
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| SMILES | O=Cc1ccc(-c2nc3ccccc3s2)o1 |
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| InChIKey | WTVOYONXUGCDPY-UHFFFAOYSA-N |
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| PubChem CID | 727559 |
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| ChEMBL | CHEMBL1386149 |
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| EC No. | 895-089-3 |
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| DTXSID | DTXSID40352474 |
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Chemical & Physical Properties
| XLogP | 2.9 |
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| Topological polar surface area | 71.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 16 |
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| Formal charge | 0 |
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| Complexity | 274 |
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| Melting point | 176 °C |
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| Boiling point | 431.5±55.0 °C(Predicted) |
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| Density | 1.381±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | 1.08±0.10(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-P280-P301+P312-P302+P352-P305+P351+P338 |
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Safety & Regulations
| GHS classification | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| 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-P280-P301+P312-P302+P352-P305+P351+P338 |
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