(2S)-hexadecan-2-ol
PubChem CID: 12526660
Connections displayed (default: 10).
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| Topological Polar Surface Area | 20.2 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 133.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2S)-hexadecan-2-ol |
| Prediction Hob | 1.0 |
| Xlogp | 7.2 |
| Molecular Formula | C16H34O |
| Prediction Swissadme | 0.0 |
| Inchi Key | FVDRFBGMOWJEOR-INIZCTEOSA-N |
| Fcsp3 | 1.0 |
| Logs | -6.103 |
| Rotatable Bond Count | 13.0 |
| Logd | 4.131 |
| Compound Name | (2S)-hexadecan-2-ol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 242.261 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 242.261 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 242.44 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.040071399999999 |
| Inchi | InChI=1S/C16H34O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h16-17H,3-15H2,1-2H3/t16-/m0/s1 |
| Smiles | CCCCCCCCCCCCCC[C@H](C)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Zingiber Officinale (Plant) Rel Props:Source_db:cmaup_ingredients