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Chemical Molecules
Molecule Details
| Molecule ID | MOL58 | ||
| Compound Name | (Z)-3-Heptadecene | ||
| ⤓Download 2D Structure File | ⤓Download 3D Structure File | View Structure Image |
Structure Image
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Primary Details
| Compound Name | (Z)-3-Heptadecene |
| Synonym Name | heptadec-3-ene |
| CAS ID | 68155-00-0 |
| IUPAC Name | (E)-heptadec-3-ene |
| Molecular Formula | C17H34 |
| Chemical Safety | |
| External Database ID |
5352250 |
| Inchi | InChI=1S/C17H34/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h5,7H,3-4,6,8-17H2,1-2H3/b7-5+ |
| INCHI Key | YICJXYRVTBRLKS-FNORWQNLSA-N |
| Canonical SMILES | CCCCCCCCCCCCCC=CCC |
| Molecule Type | Natural |
| Group | Phytochemicals |
| Sub-Group 1 | - |
| Sub-Group 2 | - |
| Sub-Group 3 | - |
| Sub-Group 4 | - |
| Sub-Group 5 | - |
| Description |
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Chemical & Physical Properties
| Molecular Weight | 238.5 g/mol |
| LogP (Octanol-Water) | 8.287 |
| Hydrogen Donor Count | 0 |
| Bond Acceptor Count | 0 |
| Rotable Bond Count | 13 |
| Topological Surface Area | 0 |
| Heavy Atom Count | 17 |
| Melting Point | Nil |
| Boiling Point | Nil |
| Water Solubility | Nil |
| Henry's Law Constant | Nil |
| pKa Dissociation Constant | Nil |
| Vapour Pressure | Nil |
| Molecule Density | |
| Molecule Stability | |
| Kovats retention Index | Standard polar: 1720, 1720.5, 1756 |
| Physical Description |
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Spectra Information
Biological Activities
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