(1R)-endo-(+)-Fenchyl alcohol
PubChem CID: 6997371
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| Compound Synonyms | (1R)-endo-(+)-Fenchyl alcohol, 2217-02-9, (+/-)-alpha-Fenchol, D-Fenchol, 14575-74-7, (1R,2R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol, endo-Fenchol, (1R-Endo)-fenchol, OW0KEP592N, alpha-Fenchol, 2-Norbornanol, 1,3,3-trimethyl-, endo-, DTXSID6044307, Bicyclo[2.2.1]heptan-2-ol, 1,3,3-trimethyl-, (1R,2R,4S)-, 32Y92U27DU, Bicyclo(2.2.1)heptan-2-ol, 1,3,3-trimethyl-, endo-, (+/-)-a-Fenchol, Bicyclo(2.2.1)heptan-2-ol, 1,3,3-trimethyl-, (1R,2R,4S)-, alpha-fenchylalcohol,endo-1,3,3-trimethyl-norbornan-2-ol,1,3,3-trimethyl-bicyclo[2.2.1]heptan-2-ol, .alpha.-Fenchol, MFCD00003760, Dl-alpha-Fenchol, (+)-fenchyl alcohol, .alpha.-Fenchyl alcohol, (1R)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-ol, Fenchylalkohol, UNII-32Y92U27DU, FEMA no. 2480, alpha-, 1R_fenchyl_alcohol, ()-Fenchol, (+)-alpha-Fenchol, alpha-(+)-Fenchol, alpha-Fenchol, (+)-, bmse000495, UNII-OW0KEP592N, Fenchyl alcohol, >=96%, DL-.ALPHA.-FENCHOL, alpha-Fenchyl alcohol, (+)-, (+)-.ALPHA.-FENCHOL, .ALPHA.-(+)-FENCHOL, CHEMBL3188732, DTXCID4024307, Fenchyl alcohol, >=96%, FG, SCHEMBL20574452, (+)-Fenchol, analytical standard, IAIHUHQCLTYTSF-OYNCUSHFSA-N, (+/-)-.ALPHA.-FENCHOL, .ALPHA.-FENCHOL, (+)-, Fenchyl alcohol, analytical standard, Tox21_301348, FE34598, FEMA NO. 2480, .ALPHA.-, .ALPHA.-FENCHYL ALCOHOL, (+)-, NCGC00255994-01, (1R)-endo-(+)-Fenchyl alcohol, 96%, CAS-2217-02-9, (+)-Fenchyl alcohol 100 microg/mL in Methanol, (1R*,2R*,4S*)-1,3,3-Trimethyl-bicyclo[2.2.1]heptan-2-ol |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 185.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 3.0 |
| Iupac Name | (1R,2R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol |
| Prediction Hob | 1.0 |
| Xlogp | 2.5 |
| Molecular Formula | C10H18O |
| Prediction Swissadme | 0.0 |
| Inchi Key | IAIHUHQCLTYTSF-OYNCUSHFSA-N |
| Fcsp3 | 1.0 |
| Logs | -2.156 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.973 |
| Compound Name | (1R)-endo-(+)-Fenchyl alcohol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 154.136 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 154.136 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 154.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.7934685999999997 |
| Inchi | InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m0/s1 |
| Smiles | C[C@@]12CC[C@@H](C1)C([C@@H]2O)(C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Abies Balsamea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Anaphalis Contorta (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Artemisia Annua (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Cedrus Deodara (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Chenopodium Botrys (Plant) Rel Props:Source_db:npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Croton Tiglium (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Curcuma Kwangsiensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Curcuma Phaeocaulis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Curcuma Wenyujin (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Curcuma Zedoaria (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 11. Outgoing r'ship
FOUND_INto/from Dysphania Botrys (Plant) Rel Props:Source_db:npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Elettaria Cardamomum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 13. Outgoing r'ship
FOUND_INto/from Foeniculum Vulgare (Plant) Rel Props:Source_db:npass_chem_all - 14. Outgoing r'ship
FOUND_INto/from Magnolia Liliflora (Plant) Rel Props:Source_db:npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Magnolia Liliiflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 16. Outgoing r'ship
FOUND_INto/from Magnolia Salicifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 17. Outgoing r'ship
FOUND_INto/from Metasequoia Glyptostroboides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 18. Outgoing r'ship
FOUND_INto/from Myristica Fragrans (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 19. Outgoing r'ship
FOUND_INto/from Pinus Radiata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 20. Outgoing r'ship
FOUND_INto/from Platycladus Orientalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 21. Outgoing r'ship
FOUND_INto/from Prunella Vulgaris (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 22. Outgoing r'ship
FOUND_INto/from Thuja Occidentalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 23. Outgoing r'ship
FOUND_INto/from Thuja Orientalis (Plant) Rel Props:Source_db:npass_chem_all - 24. Outgoing r'ship
FOUND_INto/from Zingiber Officinale (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all