11-n-Decyltetracosane
PubChem CID: 294707
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| Compound Synonyms | 11-n-Decyltetracosane, 11-Decyltetracosane, Tetracosane, 11-decyl-, 55429-84-0, DTXSID60871430, NSC163591, 11-decyl-tetracosane, 11-Decyltetracosane #, DTXCID00819098, NSC-163591, DB-250222, Q2806921 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Hydrocarbons |
| Deep Smiles | CCCCCCCCCCCCCCCCCCCCCCCC))))))))))CCCCCCCCCC |
| Heavy Atom Count | 34.0 |
| Classyfire Class | Saturated hydrocarbons |
| Classyfire Subclass | Alkanes |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 313.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 11-decyltetracosane |
| Veber Rule | False |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 18.3 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C34H70 |
| Inchi Key | BVMGLUHWZZEDRX-UHFFFAOYSA-N |
| Silicos It Class | Insoluble |
| Rotatable Bond Count | 30.0 |
| Synonyms | 11-decyl-tetracosane |
| Esol Class | Insoluble |
| Compound Name | 11-n-Decyltetracosane |
| Exact Mass | 478.548 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 478.548 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 478.9 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C34H70/c1-4-7-10-13-16-19-20-21-24-27-30-33-34(31-28-25-22-17-14-11-8-5-2)32-29-26-23-18-15-12-9-6-3/h34H,4-33H2,1-3H3 |
| Smiles | CCCCCCCCCCCCCC(CCCCCCCCCC)CCCCCCCCCC |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | False |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Jatropha Curcas (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.886965