| Phytochemical Name : 5-(3,4-Methylenedioxyphenyl)pentanoic acid |
| PCNDIDOT0896 |
| Pubchem CID : 5321853 |
| Molecular formula: C12H14O4 |
| Canonical SMILES : C1OC2=C(O1)C=C(C=C2)CCCCC(=O)O |
Synonymes : 5-(1,3-benzodioxol-5-yl)pentanoic acid|5-(3,4-Methylenedioxyphenyl)pentanoic acid|41917-45-7|1,3-Benzodioxole-5-pentanoic acid|Piperhydronic acid|Tetrahydropiperinic acid|CQ6GR7TE6Z|DTXSID90415785|CHEBI:174137|5-(1,3-dioxaindan-5-yl)pentanoic acid|1,3-Benzodioxole-5-pentanoic acid, 9CI|EN300-7462313|5-(2H-1,3-BENZODIOXOL-5-YL)PENTANOIC ACID|Z3241383247 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.160 |
| Log Po/w (XLOGP3) : 2.540 |
| Log Po/w (WLOGP) : 2.210 |
| Log Po/w (MLOGP) : 1.680 |
| Log Po/w (SILICOS-IT) : 2.620 |
| Consensus Log Po/w : 2.240 |