Heptadec-7-ene
PubChem CID: 525032
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| Compound Synonyms | 54290-12-9, heptadec-7-ene, 7-heptadecane, DTXSID30335392, DB-264090 |
|---|---|
| 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 | CCCCCCCCCC=CCCCCCC |
| Heavy Atom Count | 17.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Classyfire Subclass | Unsaturated aliphatic hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 146.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | heptadec-7-ene |
| Veber Rule | False |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 8.5 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C17H34 |
| Inchi Key | YIGCKYYSOGYETL-UHFFFAOYSA-N |
| Silicos It Class | Poorly soluble |
| Rotatable Bond Count | 13.0 |
| Synonyms | 7-heptadecane, heptadec-7-ene |
| Esol Class | Moderately soluble |
| Functional Groups | CC=CC |
| Compound Name | Heptadec-7-ene |
| Exact Mass | 238.266 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 238.266 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 238.5 |
| 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/C17H34/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h13,15H,3-12,14,16-17H2,1-2H3 |
| Smiles | CCCCCCCCCC=CCCCCCC |
| 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 Alpinia Galanga (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279