2-Tetradecene, (2Z)-
PubChem CID: 5364428
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | cis-2-tetradecene, 2-Tetradecene, (Z)-, (Z)-2-Tetradecene, 2-Tetradecene, (2Z)-, UNII-6O5S0Y06VQ, (2Z)-2-Tetradecene, 6O5S0Y06VQ, 35953-53-8, (Z)-tetradec-2-ene, (2E)-2-Tetradecene, 2-Tetradecene, trans-, Q27265221 |
|---|---|
| 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 | CCCCCCCCCCC/C=CC |
| Heavy Atom Count | 14.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Classyfire Subclass | Unsaturated aliphatic hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 113.0 |
| Database Name | cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-tetradec-2-ene |
| Prediction Hob | 1.0 |
| Veber Rule | True |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 7.0 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C14H28 |
| Prediction Swissadme | 0.0 |
| Inchi Key | OBDUMNZXAIUUTH-HYXAFXHYSA-N |
| Silicos It Class | Moderately soluble |
| Fcsp3 | 0.8571428571428571 |
| Logs | -5.777 |
| Rotatable Bond Count | 10.0 |
| Logd | 4.542 |
| Synonyms | (z)-2-tetradecene |
| Esol Class | Moderately soluble |
| Functional Groups | C/C=CC |
| Compound Name | 2-Tetradecene, (2Z)- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 196.219 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 196.219 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 196.37 |
| 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 |
| Esol | -5.2863435999999995 |
| Inchi | InChI=1S/C14H28/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,5H,4,6-14H2,1-2H3/b5-3- |
| Smiles | CCCCCCCCCCC/C=C\C |
| Nring | 0.0 |
| 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 Cnidium Officinale (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Equisetum Palustre (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2008.9700020 - 3. Outgoing r'ship
FOUND_INto/from Ligusticum Sinense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all