| Phytochemical Name : 2-Methyl-1,3-pentadiene |
| PCNDIDOT0631 |
| Pubchem CID : 638070 |
| Molecular formula: C6H10 |
| Canonical SMILES : CC=CC(=C)C |
Synonymes : 2-METHYL-1,3-PENTADIENE|(3E)-2-methylpenta-1,3-diene|926-54-5|trans-2-Methyl-1,3-pentadiene|2,4-Dimethyl-1,3-butadiene|1,3-Dimethyl-1,3-butadiene|1118-58-7|2-Methylpenta-1,3-diene|trans-2-Methylpenta-1,3-diene|EINECS 213-136-2|EINECS 214-264-1|1,3-Pentadiene, 2-methyl-, (E)-|NSC 123452|RU7NHQ8VSH|2-Methyl-1,3-pentadiene,c&t|CH2=C(CH3)CH=CHCH3|NSC-123452|NSC123452|UNII-RU7NHQ8VSH|(e)-2-methyl-1,3-pentadiene|2-methyl-penta-1,3-trans-diene|DTXSID101020907|(E)-CH2=C(CH3)CH=CHCH3|AKOS006229866|PENTA-1,3-DIENE, 2-METHYL-|1,3-pentadiene, 2-methyl-, (3E)-|TRANS-2-METHYL-1,3-PENTADIENE STAB. 98+%|W-109642 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.130 |
| Log Po/w (XLOGP3) : 2.700 |
| Log Po/w (WLOGP) : 2.140 |
| Log Po/w (MLOGP) : 2.350 |
| Log Po/w (SILICOS-IT) : 1.440 |
| Consensus Log Po/w : 2.150 |