| Phytochemical Name : 3-Methyl-3-buten-1-OL |
| PCNDIDOT0788 |
| Pubchem CID : 12988 |
| Molecular formula: C5H10O |
| Canonical SMILES : CC(=C)CCO |
Synonymes : 3-METHYL-3-BUTEN-1-OL|3-Methylbut-3-en-1-ol|763-32-6|Isoprenol|3-Buten-1-ol, 3-methyl-|Isobutenylcarbinol|Methallylcarbinol|2-Methyl-1-buten-4-ol|3-Isopentenyl alcohol|Isopropenylethyl alcohol|3-methyl-3-butenol|Methallyl carbinol|EINECS 212-110-8|UNII-KJ25C8CPFA|KJ25C8CPFA|NSC 122673|Methyl-3-but-3-en-1-ol|2-methyl-4-hydroxy-1-butene|DTXSID4052506|NSC-122673|EC 212-110-8|3-methyl-but-3-en-1-ol|3-methyl-3-butene-1-ol|3-methyl-3-butenyl alcohol|3-buten-1-ol, 3-metil-|Delta(3)-isopentenyl alcohol|2-methyl-4-hydroxybut-1-ene|3-METHYLENEBUTAN-1-OL|3-Methyl-3-buten-1-ol purum|CHEMBL3561140|DTXCID8031079|CHEBI:62898|3-Methyl-3-buten-1-ol, 97%|Tox21_303733|BBL027415|LMFA05000107|MFCD00002933|NSC122673|STL146351|3-Methyl-3-buten-1-ol, >=97%|4-HYDROXY-2-METHYL-1-BUTENE|AKOS005721136|RP10202|SB83771|NCGC00357042-01|3 - methylbut - 3 - en - 1 - ol|CAS-763-32-6|LS-47241|CS-0204343|FT-0616079|M0726|EN300-94630|A838675|Q408094|3-Methyl-3-buten-1-ol, purum, >=98.0% (GC) |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.660 |
| Log Po/w (XLOGP3) : 1.270 |
| Log Po/w (WLOGP) : 0.940 |
| Log Po/w (MLOGP) : 1.010 |
| Log Po/w (SILICOS-IT) : 0.690 |
| Consensus Log Po/w : 1.110 |