8-Methylnonan-2-ol
PubChem CID: 17975363
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| Compound Synonyms | 8-methylnonan-2-ol, 2-Nonanol, 8-methyl-, 14779-92-1, DTXSID30591850, SCHEMBL195982, DTXCID20542614, AKOS021491325 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 78.9 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 8-methylnonan-2-ol |
| Prediction Hob | 1.0 |
| Xlogp | 3.7 |
| Molecular Formula | C10H22O |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZVZKLBCGIYWGOU-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -2.595 |
| Rotatable Bond Count | 6.0 |
| Logd | 3.18 |
| Compound Name | 8-Methylnonan-2-ol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 158.167 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 158.167 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 158.28 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.750067 |
| Inchi | InChI=1S/C10H22O/c1-9(2)7-5-4-6-8-10(3)11/h9-11H,4-8H2,1-3H3 |
| Smiles | CC(C)CCCCCC(C)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Capsicum Annuum (Plant) Rel Props:Source_db:cmaup_ingredients