C16H18O3 — CID 61099011
(2,5-dimethoxyphenyl)-(3-methylphenyl)methanol (PubChem CID 61099011) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-(3-methylphenyl)methanol.
| Compound Name | (2,5-dimethoxyphenyl)-(3-methylphenyl)methanol |
|---|---|
| PubChem CID | 61099011 |
| Molecular Formula | C16H18O3 |
| Molecular Weight | 258.32 g/mol |
| Exact Mass | 258.13 |
| IUPAC Name | (2,5-dimethoxyphenyl)-(3-methylphenyl)methanol |
| SMILES | COc1ccc(OC)c(C(O)c2cccc(C)c2)c1 |
| InChI | InChI=1S/C16H18O3/c1-11-5-4-6-12(9-11)16(17)14-10-13(18-2)7-8-15(14)19-3/h4-10,16-17H,1-3H3 |
| InChIKey | AMBQSOVGXSUCSV-UHFFFAOYSA-N |
| XLogP | 3.09 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 258.32 |
| LogP ≤ 5 | 3.09 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |