HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 13542258Generated: October 23, 2026
2-Bromo-1-(4-hydroxy-3-methoxyphenyl)ethan-1-one
2-bromo-1-(4-hydroxy-3-methoxyphenyl)ethanone · 2-bromo-1-(4-hydroxy-3-methoxyphenyl)ethylone · 2-Bromo-1-(4-hydroxy-3-methoxyphenyl)ethan-1-one · Ethanone, 2-bromo-1-(4-hydroxy-3-methoxyphenyl)-
https://huagongshe.com/en/chemical/13542258
Identifiers & Physical Properties
| CAS No. | 69638-06-8 |
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| Molecular formula | C9H9BrO3 |
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| Average molar mass | 245.07 g/mol |
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| Monoisotopic mass | 243.97350625 g/mol |
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| SMILES | COc1cc(C(=O)CBr)ccc1O |
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| InChIKey | SDTPFVAZAREICN-UHFFFAOYSA-N |
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| PubChem CID | 13542258 |
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| DTXSID | DTXSID30543314 |
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Chemical & Physical Properties
| XLogP | 1.3 |
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| Topological polar surface area | 46.5 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 13 |
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| Formal charge | 0 |
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| Complexity | 184 |
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| GHS pictogram | GHS05,GHS07 |
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| Signal word | Danger |
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| GHS hazard statements | H302-H314 |
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| GHS precautionary statements | P264-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P403+P233-P501 |
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| Hazard class | IRRITANT |
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Safety & Regulations
| Signal word | Danger |
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| GHS pictogram | GHS05,GHS07 |
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| Hazard class | IRRITANT |
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| GHS hazard statements | H302-H314 |
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| GHS precautionary statements | P264-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P403+P233-P501 |
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