5-Octadecanol
PubChem CID: 33601
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 5-octadecanol, octadecan-5-ol, HTV990QRZ3, UNII-HTV990QRZ3, 26762-44-7, 79565-94-9, 5-hydroxyoctadecane, UNII-C6BPY2QY39, C6BPY2QY39, SCHEMBL2593772, DTXSID70949578, CHEBI:197463, AKOS024274088, Q27280099 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 156.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | octadecan-5-ol |
| Prediction Hob | 1.0 |
| Xlogp | 8.1 |
| Molecular Formula | C18H38O |
| Prediction Swissadme | 0.0 |
| Inchi Key | QANCZOOABLPKBN-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -6.646 |
| Rotatable Bond Count | 15.0 |
| Logd | 4.46 |
| Compound Name | 5-Octadecanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 270.292 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 270.292 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 270.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.6112062 |
| Inchi | InChI=1S/C18H38O/c1-3-5-7-8-9-10-11-12-13-14-15-17-18(19)16-6-4-2/h18-19H,3-17H2,1-2H3 |
| Smiles | CCCCCCCCCCCCCC(CCCC)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Angelica Dahurica (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Cicuta Virosa (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Clematis Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Codonopsis Pilosula (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Salvia Bowleyana (Plant) Rel Props:Source_db:cmaup_ingredients