2-Decenol, (2E)-
PubChem CID: 5364942
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| Compound Synonyms | trans-2-Decen-1-ol, 18409-18-2, 2-Decen-1-ol, (E)-dec-2-en-1-ol, (E)-2-Decenol, 2-Decenol, trans-2-Decenol, 2-Decen-1-ol, (E)-, 2-Decenol, (2E)-, Dec-2-enol, 22104-80-9, EINECS 242-289-8, T46421D2F4, 2-DECENOL, (E)-, AI3-36045, FEMA NO. 4304, TRANS-2-DECENOL [FHFI], 2-DECEN-1-OL, TRANS-, DTXSID701016140, UNII-T46421D2F4, (2E)-2-decenol, E-2-decen-1-ol, Dec-2-en-1-al, SCHEMBL295757, CHEMBL2228372, DTXCID20211393, LMFA05000142, AKOS024387376, HY-W679967, NS00012197, Q27289647, 242-289-8, 244-784-4 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols |
| Deep Smiles | CCCCCCC/C=C/CO |
| Heavy Atom Count | 11.0 |
| Classyfire Class | Fatty acyls |
| Description | It is used as a food additive . |
| Classyfire Subclass | Fatty alcohols |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 86.9 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (E)-dec-2-en-1-ol |
| Prediction Hob | 1.0 |
| Class | Fatty Acyls |
| Veber Rule | True |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Xlogp | 3.6 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Fatty alcohols |
| Gsk 4 400 Rule | True |
| Molecular Formula | C10H20O |
| Prediction Swissadme | 1.0 |
| Inchi Key | QOPYYRPCXHTOQZ-CMDGGOBGSA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 0.8 |
| Rotatable Bond Count | 7.0 |
| Synonyms | 2-decen-1-ol, 2-Decenol, Dec-2-enol, 2-Decen-1-ol, (e)-2-decen-1-ol, 2-decen-1-ol, 2-decenol, e-2-decen-1-ol |
| Esol Class | Soluble |
| Functional Groups | C/C=C/C, CO |
| Compound Name | 2-Decenol, (2E)- |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 156.151 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 156.151 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 156.26 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | -2.5896677999999995 |
| Inchi | InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h8-9,11H,2-7,10H2,1H3/b9-8+ |
| Smiles | CCCCCCC/C=C/CO |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 1.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Fatty alcohols |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Bergenia Purpurascens (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.1689 - 2. Outgoing r'ship
FOUND_INto/from Bergenia Stracheyi (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.1689 - 3. Outgoing r'ship
FOUND_INto/from Coriandrum Sativum (Plant) Rel Props:Reference:https://doi.org/10.1080/0972-060x.2004.10643364 - 4. Outgoing r'ship
FOUND_INto/from Houttuynia Cordata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Origanum Onites (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2009.10643745 - 6. Outgoing r'ship
FOUND_INto/from Zanthoxylum Rhetsa (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2000.9699492 - 7. Outgoing r'ship
FOUND_INto/from Zea Mays (Plant) Rel Props:Reference:https://www.ncbi.nlm.nih.gov/pubmed/21191806