Methyl Dodecanoate
Representations & DB's id
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| ChEBI: | CHEBI:87494 | |
|---|---|---|
| ChEMBL: | CHEMBL1894365 | |
| PubChem: | 8139 | |
| IUPAC: | methyl dodecanoate | |
| Standard InChI: | InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3 | |
| Standard InChI Key: | UQDUPQYQJKYHQI-UHFFFAOYSA-N | |
| SMILES: | CCCCCCCCCCCC(=O)OC | |
Molecular propeties
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| AlogP: | 4.08 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 10 | |
| Number of rings: | 0 | |
| Molecular Weight: | 214.19 | |
| Topological polar surface area: | 26.3 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.923 | |
| Number of carbons: | 13 | |