| Phytochemical Name : 2-Isopropyl-5-methylanisole |
| PCNDIDOT0619 |
| Pubchem CID : 14104 |
| Molecular formula: C11H16O |
| Canonical SMILES : CC1=CC(=C(C=C1)C(C)C)OC |
Synonymes : Thymol methyl ether|2-Isopropyl-5-methylanisole|1076-56-8|O-Methylthymol|Thymyl methyl ether|Methyl thymyl ether|3-Methoxy-p-cymene|4-Isopropyl-3-methoxytoluene|1-Isopropyl-2-methoxy-4-methylbenzene|Methyl thymol ether|Benzene, 2-methoxy-4-methyl-1-(1-methylethyl)-|ANISOLE, 2-ISOPROPYL-5-METHYL-|2-methoxy-4-methyl-1-propan-2-ylbenzene|Methylthymol, o-|1-Methyl-3-methoxy-4-isopropylbenzene|Benzene,2-methoxy-4-methyl-1-(1-methylethyl)-|methylthymol|FEMA No. 3436|Thymol methyl|thymol Me ether|2-Methoxy-4-methyl-1-(1-methylethyl)benzene|2-methoxy-4-methyl-1-(propan-2-yl)benzene|Fema3436|EINECS 214-063-9|NSC 404221|BRN 2042889|UNII-VTE0C4390U|AI3-03431|VTE0C4390U|DTXSID5047617|NSC-404221|4-06-00-03335 (Beilstein Handbook Reference)|thymyl methyl oxide|Methyl THYMYL oxide|starbld0009587|Thymol derivative, 21|O(C)c1cc(C)ccc1C(C)C|3-METHOXY-PARA-CYMENE|SCHEMBL196752|2-Isopropyl-5-methyl-Anisole|CHEMBL2424841|DTXCID3027617|CHEBI:167336|BDBM248170|Tox21_302575|2 - isopropyl - 5 - methylanisole|MFCD01674973|NSC404221|2-ISO PROPYL-5-METHYLANISOLE|AKOS015914183|Thymol methyl ether (= methyl thymol)|NCGC00256877-01|LS-13985|LS-20213|CAS-1076-56-8|CS-0335474|FT-0754651|I0996|1-Methyl-3-methoxy-4-isopropylbenzene, 98%|D91215|Q27292012|1-METHYL-3-METHOXY-4-ISOPROPYL BENZENE [FHFI]|1-Isopropyl-2-methoxy-4-methylbenzene, analytical standard |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.770 |
| Log Po/w (XLOGP3) : 3.750 |
| Log Po/w (WLOGP) : 3.130 |
| Log Po/w (MLOGP) : 3.050 |
| Log Po/w (SILICOS-IT) : 3.290 |
| Consensus Log Po/w : 3.200 |