Octadecane, 3-ethyl-5-(2-ethylbutyl)-
PubChem CID: 292285
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| Compound Synonyms | 3-Ethyl-5-(2-ethylbutyl)octadecane, Octadecane, 3-ethyl-5-(2-ethylbutyl)-, 55282-12-7, 3-Ethyl-5-(2'-ethylbutyl)octadecane, DTXSID50303356, NSC157984, DTXCID80254488, CHEBI:192074, NSC-157984, 3-Ethyl-5-(2-ethylbutyl)octadecane #, DB-252479, OCTADECENE,3-ETHYL-5-(2-ETHYLBUTYL)- |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 26.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 235.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 3-ethyl-5-(2-ethylbutyl)octadecane |
| Prediction Hob | 0.0 |
| Xlogp | 13.4 |
| Molecular Formula | C26H54 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MFLJAIATZVGFPM-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -7.867 |
| Rotatable Bond Count | 20.0 |
| Logd | 6.543 |
| Compound Name | Octadecane, 3-ethyl-5-(2-ethylbutyl)- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 366.423 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 366.423 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 366.7 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -9.254551600000001 |
| Inchi | InChI=1S/C26H54/c1-6-11-12-13-14-15-16-17-18-19-20-21-26(22-24(7-2)8-3)23-25(9-4)10-5/h24-26H,6-23H2,1-5H3 |
| Smiles | CCCCCCCCCCCCCC(CC(CC)CC)CC(CC)CC |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Maxima (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all