2,6-Dimethylnonane
PubChem CID: 28457
Connections displayed (default: 10).
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| Compound Synonyms | 2,6-DIMETHYLNONANE, Nonane, 2,6-dimethyl-, 17302-28-2, 2,6-dimethyl-nonane, Nonane,2,6-dimethyl-, DTXSID80938276, CHEBI:183301, DTXCID001366815, LMFA11000614 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 74.1 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,6-dimethylnonane |
| Prediction Hob | 1.0 |
| Xlogp | 5.6 |
| Molecular Formula | C11H24 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MGNGOEWESNDQAN-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -4.312 |
| Rotatable Bond Count | 6.0 |
| Logd | 2.469 |
| Compound Name | 2,6-Dimethylnonane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 156.188 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 156.188 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 156.31 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.9411405999999998 |
| Inchi | InChI=1S/C11H24/c1-5-7-11(4)9-6-8-10(2)3/h10-11H,5-9H2,1-4H3 |
| Smiles | CCCC(C)CCCC(C)C |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Atractylodes Lancea (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Atractylodes Macrocephala (Plant) Rel Props:Source_db:cmaup_ingredients