| Phytochemical Name : 2,6-Dimethylnaphthalene |
| PCNDIDOT0552 |
| Pubchem CID : 11387 |
| Molecular formula: C12H12 |
| Canonical SMILES : CC1=CC2=C(C=C1)C=C(C=C2)C |
Synonymes : 2,6-DIMETHYLNAPHTHALENE|581-42-0|Naphthalene, 2,6-dimethyl-|2,6-DMN|2,6-Dimethyl-naphthalene|UNII-76U29QW3FM|76U29QW3FM|CHEMBL194983|DTXSID0029187|CHEBI:34251|C14330|EINECS 209-464-0|MFCD00004120|NSC 36852|NSC-36852|Naphthalene, 2,6-(or 2,7)-dimethyl-|AI3-01876|96789-56-9|Naphthalene,dimethyl-|Boronicacid, B-butyl-|2.6-dimethylnaphthalene|2,6-dimethyl-naphtalene|BIDD:ER0559|DTXCID309187|2,6-Dimethylnaphthalene, 99%|AMY38494|NSC36852|Tox21_200260|BDBM50159257|STL507993|AKOS015842594|CS-W017996|NCGC00248581-01|NCGC00248581-02|NCGC00257814-01|CAS-581-42-0|J45.113D|LS-14057|A8250|D0751|FT-0625147|J-017269|Q-102015|Q2250787|F0001-1516|Dimethylnaphthalene (technical) 10 microg/mL in Cyclohexane |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.480 |
| Log Po/w (XLOGP3) : 4.310 |
| Log Po/w (WLOGP) : 3.460 |
| Log Po/w (MLOGP) : 4.830 |
| Log Po/w (SILICOS-IT) : 3.970 |
| Consensus Log Po/w : 3.810 |