Identifiers & Physical Properties
| CAS No. | 1839-11-8 |
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| Molecular formula | C18H32O2 |
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| Average molar mass | 280.4 g/mol |
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| Monoisotopic mass | 280.24023026 g/mol |
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| SMILES | CCCCCCC=CC=CCCCCCCCC(=O)O |
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| InChIKey | JBYXPOFIGCOSSB-UHFFFAOYSA-N |
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| PubChem CID | 74607 |
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| EC No. | 606-010-7 |
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| DTXSID | DTXSID6041006 |
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Chemical & Physical Properties
| XLogP | 7.1 |
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| Topological polar surface area | 37.3 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 14 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 267 |
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Safety & Regulations
| Regulatory information | 9,11-Octadecadienoic acid: Does not have an individual approval but may be used under an appropriate group standard |
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