1,2,3,4,5,8-Hexahydronaphthalene
PubChem CID: 142062
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| Compound Synonyms | 1,2,3,4,5,8-Hexahydronaphthalene, 36231-13-7, DTXSID00189783, DTXCID60112274, AKOS006273259 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 164.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,2,3,4,5,8-hexahydronaphthalene |
| Prediction Hob | 1.0 |
| Xlogp | 2.6 |
| Molecular Formula | C10H14 |
| Prediction Swissadme | 0.0 |
| Inchi Key | CCLPTDRLVDMCRP-UHFFFAOYSA-N |
| Fcsp3 | 0.6 |
| Logs | -2.601 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.385 |
| Compound Name | 1,2,3,4,5,8-Hexahydronaphthalene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 134.11 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 134.11 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 134.22 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.3416764 |
| Inchi | InChI=1S/C10H14/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2H,3-8H2 |
| Smiles | C1CCC2=C(C1)CC=CC2 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Leonurus Japonicus (Plant) Rel Props:Source_db:cmaup_ingredients