8-Heptadecene
PubChem CID: 5364555
Connections displayed (default: 10).
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| Compound Synonyms | 8-Heptadecene, (E)-heptadec-8-ene, 16369-12-3, 8-Heptadecene, (8E)-, 2579-04-6, 16416-42-5, MFCD00060976, trans-heptadec-8-ene, (8E)-8-Heptadecene, (8E)-8-Heptadecene #, (8E)-HEPTADEC-8-ENE, D84389 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 146.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (E)-heptadec-8-ene |
| Prediction Hob | 1.0 |
| Xlogp | 8.5 |
| Molecular Formula | C17H34 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BIQKRILZMDQPHI-BMRADRMJSA-N |
| Fcsp3 | 0.8823529411764706 |
| Logs | -6.89 |
| Rotatable Bond Count | 13.0 |
| Logd | 5.075 |
| Compound Name | 8-Heptadecene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 238.266 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 238.266 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 238.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -5.8091458 |
| Inchi | InChI=1S/C17H34/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h15,17H,3-14,16H2,1-2H3/b17-15+ |
| Smiles | CCCCCCCC/C=C/CCCCCCC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Angelica Acutiloba (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Angelica Gigas (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Angelica Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Asarum Heterotropoides (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Asarum Sieboldii (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Uncaria Macrophylla (Plant) Rel Props:Source_db:cmaup_ingredients