6Z,9Z-Heneicosadiene
PubChem CID: 10979225
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| Compound Synonyms | 6Z,9Z-Heneicosadiene, (z,z)-6,9-heneicosadiene, LMFA11000140 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 21.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 224.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (6Z,9Z)-henicosa-6,9-diene |
| Prediction Hob | 0.0 |
| Xlogp | 10.0 |
| Molecular Formula | C21H40 |
| Prediction Swissadme | 0.0 |
| Inchi Key | PKSRTLMYBDFSLD-OHNCOSGTSA-N |
| Fcsp3 | 0.8095238095238095 |
| Logs | -1.887 |
| Rotatable Bond Count | 16.0 |
| Logd | 0.827 |
| Compound Name | 6Z,9Z-Heneicosadiene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 292.313 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 292.313 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 292.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 2.0 |
| Esol | -6.8789162 |
| Inchi | InChI=1S/C21H40/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-21H2,1-2H3/b13-11-,19-17- |
| Smiles | CCCCCCCCCCC/C=C\C/C=C\CCCCC |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 2.0 |
- 1. Outgoing r'ship
FOUND_INto/from Argemone Mexicana (Plant) Rel Props:Source_db:cmaup_ingredients