(3,6-Dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol
PubChem CID: 5319301
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| Topological Polar Surface Area | 29.5 |
|---|---|
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 222.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol |
| Prediction Hob | 1.0 |
| Xlogp | 0.7 |
| Molecular Formula | C10H16O2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | FRJFTZREOBRUSS-UHFFFAOYSA-N |
| Fcsp3 | 0.8 |
| Logs | -1.501 |
| Rotatable Bond Count | 1.0 |
| Logd | 1.423 |
| Compound Name | (3,6-Dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 168.115 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 168.115 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 168.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.2454631999999999 |
| Inchi | InChI=1S/C10H16O2/c1-7-5-12-10(6-11)8(2)3-4-9(7)10/h3,7,9,11H,4-6H2,1-2H3 |
| Smiles | CC1COC2(C1CC=C2C)CO |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Actinidia Polygama (Plant) Rel Props:Source_db:cmaup_ingredients