9-Methyloctadec-9-ene
PubChem CID: 54259429
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| Compound Synonyms | 9-methyloctadec-9-ene |
|---|---|
| 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 | CCCCCCCCC=CCCCCCCCC))))))))C |
| Heavy Atom Count | 19.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Classyfire Subclass | Branched unsaturated hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 190.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 9-methyloctadec-9-ene |
| Veber Rule | False |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 9.7 |
| Gsk 4 400 Rule | False |
| Molecular Formula | C19H38 |
| Inchi Key | RCKXFWRCJBTHNQ-UHFFFAOYSA-N |
| Silicos It Class | Poorly soluble |
| Rotatable Bond Count | 14.0 |
| Synonyms | 9-methyl-octadec-9-ene, 9-methyloctadec-9-ene |
| Esol Class | Poorly soluble |
| Functional Groups | CC=C(C)C |
| Compound Name | 9-Methyloctadec-9-ene |
| Exact Mass | 266.297 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 266.297 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 266.5 |
| 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/C19H38/c1-4-6-8-10-12-14-16-18-19(3)17-15-13-11-9-7-5-2/h18H,4-17H2,1-3H3 |
| Smiles | CCCCCCCCC=C(C)CCCCCCCC |
| 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 Cissus Quadrangularis (Plant) Rel Props:Reference:ISBN:9788185042145