2,2,6,6-Tetramethyl-3-methylidenebicyclo[2.2.1]heptane
PubChem CID: 46173196
Connections displayed (default: 10).
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| Topological Polar Surface Area | 0.0 |
|---|---|
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 232.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,2,6,6-tetramethyl-3-methylidenebicyclo[2.2.1]heptane |
| Prediction Hob | 1.0 |
| Xlogp | 4.0 |
| Molecular Formula | C12H20 |
| Prediction Swissadme | 0.0 |
| Inchi Key | CJJCDFKNRQRNMW-UHFFFAOYSA-N |
| Fcsp3 | 0.8333333333333334 |
| Logs | -5.557 |
| Rotatable Bond Count | 0.0 |
| Logd | 4.403 |
| Compound Name | 2,2,6,6-Tetramethyl-3-methylidenebicyclo[2.2.1]heptane |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 164.157 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 164.157 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 164.29 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.3534103999999996 |
| Inchi | InChI=1S/C12H20/c1-8-9-6-10(12(8,4)5)11(2,3)7-9/h9-10H,1,6-7H2,2-5H3 |
| Smiles | CC1(CC2CC1C(C2=C)(C)C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Lycopodium Japonicum (Plant) Rel Props:Source_db:cmaup_ingredients