| Phytochemical Name : 1,2,3-Trimethoxybenzene |
| PCNDIDOT0322 |
| Pubchem CID : 12462 |
| Molecular formula: C9H12O3 |
| Canonical SMILES : COC1=C(C(=CC=C1)OC)OC |
Synonymes : 1,2,3-TRIMETHOXYBENZENE|634-36-6|Pyrogallol trimethyl ether|Benzene, trimethoxy-|Tri-O-methylpyrogallol|Benzene, 1,2,3-trimethoxy-|Trimethoxybenzene|1,2,3-trimethoxy benzene|Methylsyringol (VAN)|1,2,3-Trimethoxybenzen|MFCD00008358|UNII-MRE1O894FG|1,2,3-trimethoxy-benzene|MRE1O894FG|EINECS 211-207-2|NSC 10124|NSC-10124|AI3-02077|1,3-Trimethoxybenzene|2,3,4-trimethoxybenzene|1.2.3-Trimethoxybenzene|bmse010218|Cambridge id 5108143|63744-60-5|SCHEMBL151213|UNII-5PPX04J036|DTXSID1060899|CHEBI:86529|CRUILBNAQILVHZ-UHFFFAOYSA-|1,2,3-Trimethoxybenzene, 98%|HMS1577E02|BCP33591|NSC10124|STK499049|AKOS000120025|CS-W017808|HY-W017092|AS-12689|SY036393|FT-0606231|T1102|EN300-20240|D70961|A834379|AH-034/32464032|Q-200055|Pyrogallol trimethyl ether;Benzene, 1,2,3-trimethoxy-|Q27159216|F0001-1721|Z104477452 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.290 |
| Log Po/w (XLOGP3) : 1.530 |
| Log Po/w (WLOGP) : 1.710 |
| Log Po/w (MLOGP) : 1.180 |
| Log Po/w (SILICOS-IT) : 1.820 |
| Consensus Log Po/w : 1.710 |