| Phytochemical Name : 2,2-Dimethylpentane |
| PCNDIDOT0480 |
| Pubchem CID : 11542 |
| Molecular formula: C7H16 |
| Canonical SMILES : CCCC(C)(C)C |
Synonymes : 2,2-DIMETHYLPENTANE|590-35-2|Pentane, 2,2-dimethyl-|1,1,1-Trimethylbutane|EINECS 209-680-5|UNII-M82T90QEVX|M82T90QEVX|2,2-dimethyl-pentane|DTXSID5060439|2,2-Dimethylpentane, >=99%|MFCD00009404|AKOS015841490|D1673|FT-0609278|D87693|Q2813768 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.490 |
| Log Po/w (XLOGP3) : 3.570 |
| Log Po/w (WLOGP) : 2.830 |
| Log Po/w (MLOGP) : 3.870 |
| Log Po/w (SILICOS-IT) : 1.900 |
| Consensus Log Po/w : 2.930 |