(-)-alpha-Fenchene
PubChem CID: 10887972
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| Compound Synonyms | (-)-alpha-fenchene, DTXSID601215909, 116724-26-6, Q24791131, (1R,4S)-7,7-Dimethyl-2-methylenebicyclo[2.2.1]heptane |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 176.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (1R,4S)-7,7-dimethyl-2-methylidenebicyclo[2.2.1]heptane |
| Prediction Hob | 1.0 |
| Xlogp | 3.1 |
| Molecular Formula | C10H16 |
| Prediction Swissadme | 0.0 |
| Inchi Key | XCPQUQHBVVXMRQ-DTWKUNHWSA-N |
| Fcsp3 | 0.8 |
| Logs | -3.969 |
| Rotatable Bond Count | 0.0 |
| Logd | 3.897 |
| Compound Name | (-)-alpha-Fenchene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 136.125 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 136.125 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 136.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.6313756 |
| Inchi | InChI=1S/C10H16/c1-7-6-8-4-5-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9+/m0/s1 |
| Smiles | CC1([C@H]2CC[C@@H]1C(=C)C2)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Valeriana Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all