HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19088027Generated: October 27, 2026
1-Iodo-4-(2,5-dimethoxy-3,4,6-trimethylphenyl)-4-phenylbutane
https://huagongshe.com/en/chemical/19088027
Identifiers & Physical Properties
| Molecular formula | C21H27IO2 |
|---|
| Average molar mass | 438.3 g/mol |
|---|
| SMILES | COc1c(C)c(C)c(OC)c(C(CCCI)c2ccccc2)c1C |
|---|
| InChIKey | KXUBJGMYNQRMRZ-UHFFFAOYSA-N |
|---|
| PubChem CID | 19088027 |
|---|
Chemical & Physical Properties
| XLogP | 7 |
|---|
| Topological polar surface area | 18.5 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 2 |
|---|
| Rotatable bonds | 7 |
|---|
| Heavy atoms | 24 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 356 |
|---|
