HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 16768941Generated: October 23, 2026
4-Bromo-2,5-dimethylfuran-3-carboxylic acid
4-bromo-2,5-dimethylfuran-3-carboxylic acid · BBV-004083 · 4-bromo-2,5-dimethyl-3-furoic acid · 4-bromo-2,5-dimethyl-3-furancarboxylic acid · 4-bromo-2,5-dimethyl-furan-3-carboxylic acid · 3-Furancarboxylic acid, 4-bromo-2,5-dimethyl-
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Identifiers & Physical Properties
| CAS No. | 857821-46-6 |
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| Molecular formula | C7H7BrO3 |
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| Average molar mass | 219.03 g/mol |
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| SMILES | Cc1oc(C)c(C(=O)O)c1Br |
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| InChIKey | DSUSYVCPBAFOQR-UHFFFAOYSA-N |
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| PubChem CID | 16768941 |
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| EC No. | 825-504-5 |
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Chemical & Physical Properties
| XLogP | 2 |
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| Topological polar surface area | 50.4 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 1 |
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| Heavy atoms | 11 |
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| Formal charge | 0 |
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| Complexity | 171 |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H315-H319-H335 |
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| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501 |
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Safety & Regulations
| GHS classification | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 | Skin Irrit. 2 (100%) |
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| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H315-H319-H335 |
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| GHS precautionary statements | P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501 |
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