(+)-Santolina alcohol
PubChem CID: 12315281
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | (+)-Santolina alcohol, 35671-15-9, (3S)-3-ETHENYL-2,5-DIMETHYLHEX-4-EN-2-OL, (S)-2,5-Dimethyl-3-vinylhex-4-en-2-ol, DTXSID80487451, 4-Hexen-2-ol, 3-ethenyl-2,5-dimethyl-, (S)-, 4-Hexen-2-ol, 3-ethenyl-2,5-dimethyl-, (3S)-, DTXCID80438261, AKOS017343047, SMP2_000316, (+)-Santolina alcohol, analytical standard |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 162.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (3S)-3-ethenyl-2,5-dimethylhex-4-en-2-ol |
| Prediction Hob | 1.0 |
| Xlogp | 2.7 |
| Molecular Formula | C10H18O |
| Prediction Swissadme | 1.0 |
| Inchi Key | JWGLVEFPXSKNBN-VIFPVBQESA-N |
| Fcsp3 | 0.6 |
| Logs | -1.809 |
| Rotatable Bond Count | 3.0 |
| Logd | 2.481 |
| Compound Name | (+)-Santolina alcohol |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 154.136 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 154.136 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 154.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.3119686 |
| Inchi | InChI=1S/C10H18O/c1-6-9(7-8(2)3)10(4,5)11/h6-7,9,11H,1H2,2-5H3/t9-/m0/s1 |
| Smiles | CC(=C[C@H](C=C)C(C)(C)O)C |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Hopea Parviflora (Plant) Rel Props:Source_db:cmaup_ingredients