HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 554136Generated: October 27, 2026
Methyl 15-bromopentadecanoate
methyl 15-bromopentadecanoate · 15-Bromopentadecanoic acid methyl ester · Pentadecanoic acid, 15-bromo-, methyl ester
https://huagongshe.com/en/chemical/554136
Identifiers & Physical Properties
| CAS No. | 41240-56-6 |
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| Molecular formula | C16H31BrO2 |
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| Average molar mass | 335.32 g/mol |
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| Monoisotopic mass | 334.15074 g/mol |
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| SMILES | COC(=O)CCCCCCCCCCCCCCBr |
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| InChIKey | BVQSDPDEVQSPMW-UHFFFAOYSA-N |
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| PubChem CID | 554136 |
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| DTXSID | DTXSID90339159 |
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Chemical & Physical Properties
| XLogP | 6.8 |
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| Topological polar surface area | 26.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 15 |
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| Heavy atoms | 19 |
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| Formal charge | 0 |
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| Complexity | 195 |
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| Melting point | 40 °C |
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| Boiling point | 186 °C(Press: 2 Torr) |
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| Density | 1.084±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 | P280-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 | P280-P305+P351+P338 |
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