10-Heptadecenoic acid, methyl ester
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CAS Number 369657-02-3
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Catalog Number io-406972
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Molecular Weight 282.5000
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SMILES
| Size | QTY | Notes | |
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| 1 | methyl (E)-heptadec-10-enoate |
| 2 | DELTA 10 TRANS HEPTADECENOIC ACID METHYL ESTER |
| 3 | 10-Heptadecenoic acid, methyl ester |
| 4 | Methyl cis-10-heptadecenoate |
| 5 | (Z)-Methyl heptadec-10-enoate |
| Molecular Formula | C18H34O2 |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 282.5000 |
| InChIKey | JNSUZRHLHDQGPN-CMDGGOBGSA-N |
| InChI | InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h8-9H,3-7,10-17H2,1-2H3/b9-8+ |
| XLogP | 7.1000 |
| ExactMass | 282.2559 |
| MonoisotopicMass | 282.2559 |
| TPSA | 26.3000 |
| Complexity | 234.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 2 |
| RotatableBondCount | 15 |
| HeavyAtomCount | 20 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 1 |
| DefinedBondStereoCount | 1 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 21 |
| PatentFamilyCount | 8 |
| LiteratureCount | 5 |
