2-Decen-1-ol
PubChem CID: 87630
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| Compound Synonyms | 2-Decen-1-ol, Dec-2-en-1-ol, (E)-2-decen-1-ol, DTXSID4066759, 22104-80-9, EINECS 244-784-4, DTXCID3036608, MFCD00014059, SY343166, DB-045794, NS00083862 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Description | Dec-2-en-1-al is a member of the class of compounds known as fatty alcohols. Fatty alcohols are aliphatic alcohols consisting of a chain of a least six carbon atoms. Dec-2-en-1-al is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Dec-2-en-1-al can be found in carrot and wild carrot, which makes dec-2-en-1-al a potential biomarker for the consumption of these food products. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 86.9 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | dec-2-en-1-ol |
| Prediction Hob | 1.0 |
| Class | Fatty Acyls |
| Xlogp | 3.6 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Fatty alcohols |
| Molecular Formula | C10H20O |
| Prediction Swissadme | 1.0 |
| Inchi Key | QOPYYRPCXHTOQZ-UHFFFAOYSA-N |
| Fcsp3 | 0.8 |
| Rotatable Bond Count | 7.0 |
| Compound Name | 2-Decen-1-ol |
| 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 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| 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 |
| Smiles | CCCCCCCC=CCO |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Fatty alcohols |
- 1. Outgoing r'ship
FOUND_INto/from Daucus Carota (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all