| Synonyms | |
| Molecule Category | Free-form |
| UNII | JV0QT00NUE |
| EPA CompTox | DTXSID9021689 |
| Source | Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ... |
Structure
| InChI Key | RSJKGSCJYJTIGS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H24 |
| Molecular Weight | 156.31 |
| AlogP | 5.39 |
| Number of Rotational Bond | 8.0 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1120-21-4 |
| ChEMBL | CHEMBL132474 |
| FDA SRS | JV0QT00NUE |
| PDB | UND |
| PubChem | 14257 |
| SureChEMBL | SCHEMBL25023 |
CONTENTS
