cis-7-Tetradecenol
PubChem CID: 5362795
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| Compound Synonyms | CIS-7-TETRADECENOL, (Z)-tetradec-7-en-1-ol, 40642-43-1, Z-7-Tetradecenol, (Z)-7-tetradecenol, 7Z-Tetradecen-1-ol, cis-7-Tetradecen-1-ol, (Z)-7-Tetradecen-1-ol, (7Z)-Tetradecen-1-ol, 7-Tetradecenol, Z, (7Z)-7-Tetradecen-1-ol, 7-Tetradecen-1-ol, (Z), SCHEMBL366675, HY-N12898, LMFA05000183, CS-1054468, G67146, 631-022-4 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 15.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 129.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-tetradec-7-en-1-ol |
| Prediction Hob | 1.0 |
| Xlogp | 5.3 |
| Molecular Formula | C14H28O |
| Prediction Swissadme | 0.0 |
| Inchi Key | QXYAJPQXTGQWRU-FPLPWBNLSA-N |
| Fcsp3 | 0.8571428571428571 |
| Logs | -3.019 |
| Rotatable Bond Count | 11.0 |
| Logd | 1.745 |
| Compound Name | cis-7-Tetradecenol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 212.214 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 212.214 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 212.37 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -3.7571373999999995 |
| Inchi | InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h7-8,15H,2-6,9-14H2,1H3/b8-7- |
| Smiles | CCCCCC/C=C\CCCCCCO |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Angelica Acutiloba (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Angelica Gigas (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Angelica Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Cinnamomum Aromaticum (Plant) Rel Props:Source_db:cmaup_ingredients