| Phytochemical Name : 2,2-Dimethylchroman-6-carboxylic acid |
| PCNDIDOT0478 |
| Pubchem CID : 222064 |
| Molecular formula: C12H14O3 |
| Canonical SMILES : CC1(CCC2=C(O1)C=CC(=C2)C(=O)O)C |
Synonymes : 2039-47-6|2,2-dimethylchroman-6-carboxylic acid|2,2-Dimethylchromane-6-carboxylic acid|2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid|2,2-dimethyl-3,4-dihydrochromene-6-carboxylic acid|NSC7291|CHEMBL61004|2,2-Dimethyl-6-carboxychroman|SCHEMBL3880185|DTXSID00278429|CAA03947|NSC-7291|NSC106255|2,2-dimethyl-6-chromancarboxylic acid|AKOS004115373|NSC-106255|2,2-Dimethyl-chroman-6-carboxylic acid|EN300-1843126|Z1508916976 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.130 |
| Log Po/w (XLOGP3) : 2.430 |
| Log Po/w (WLOGP) : 2.490 |
| Log Po/w (MLOGP) : 2.120 |
| Log Po/w (SILICOS-IT) : 2.600 |
| Consensus Log Po/w : 2.350 |