6-Tridecene
PubChem CID: 5364429
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| Compound Synonyms | 6-Tridecene, (E)-6-Tridecene, trans-6-tridecene, 6-Tridecene, (6E)-, 6-Tridecene, (E)-, zeta-trans-Tridecene, UNII-MC936310TD, 6434-76-0, MC936310TD, 24949-38-0, tridec-6-ene, (6E)-6-Tridecene, 6-Tridecene, (E), .ZETA.-TRANS-TRIDECENE, DTXSID80214562, QHOMPCGOCNNMFK-ACCUITESSA-N, LMFA11000480, Q27283850 |
|---|---|
| Ghose Rule | True |
| 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 | CCCCCC/C=C/CCCCC |
| Heavy Atom Count | 13.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Classyfire Subclass | Unsaturated aliphatic hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 103.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (E)-tridec-6-ene |
| Veber Rule | True |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 6.3 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C13H26 |
| Inchi Key | QHOMPCGOCNNMFK-ACCUITESSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 9.0 |
| Synonyms | trans- (6)-tridecene |
| Esol Class | Moderately soluble |
| Functional Groups | C/C=C/C |
| Compound Name | 6-Tridecene |
| Exact Mass | 182.203 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 182.203 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 182.35 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h11,13H,3-10,12H2,1-2H3/b13-11+ |
| Smiles | CCCCCC/C=C/CCCCC |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 1.0 |
| Egan Rule | True |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Morina Longifolia (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2018.1437782