2-Methylbicyclo[2.2.1]heptan-2-ol
PubChem CID: 296920
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| Compound Synonyms | 2-Methylbicyclo[2.2.1]heptan-2-ol, 5240-73-3, Bicyclo[2.2.1]heptan-2-ol, 2-methyl-, 2-Methyl-endo-norbornanol, endo-2-Methyl-2-norborneol, endo-2-Methyl-2-norbornanol, 2-Methylbicyclo[2.2.1]heptan-endo-2-ol, 2-Norbornanol, stereoisomer, 3212-15-5, 3212-16-6, NSC167485, 2-methyl-2-norbornanol, 2-methylnorbornan-2-ol, 2-endo-Methyl-exo-fenchol, exo-2-Methyl-2-norborneol, exo-2-Methyl-2-norbornanol, Bicyclo[2.2.1]heptan-2-ol, 2-methyl-, endo-, 2-exo-Methyl-endo-camphenilol, SCHEMBL2277715, DTXSID50953996, NSC167491, AKOS021985765, NSC-167485, NSC-167491, 2-Norbornanol, 2-methyl-, stereoisomer, 2-Methylbicyclo[2.2.1]heptan-2-ol, endo-, EN300-1241638 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 133.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-methylbicyclo[2.2.1]heptan-2-ol |
| Prediction Hob | 1.0 |
| Xlogp | 1.5 |
| Molecular Formula | C8H14O |
| Prediction Swissadme | 0.0 |
| Inchi Key | QBAQBGVSOIIKBF-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | -4.751 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.756 |
| Compound Name | 2-Methylbicyclo[2.2.1]heptan-2-ol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 126.104 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 126.104 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 126.2 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.5485338 |
| Inchi | InChI=1S/C8H14O/c1-8(9)5-6-2-3-7(8)4-6/h6-7,9H,2-5H2,1H3 |
| Smiles | CC1(CC2CCC1C2)O |
| Nring | 6.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Eucalyptus Tereticornis (Plant) Rel Props:Source_db:cmaup_ingredients