4-(2,4,4-Trimethylpentan-2-Yl)Phenol
Representations & DB's id
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| ChEBI: | CHEBI:34445 | |
|---|---|---|
| ChEMBL: | CHEMBL259327 | |
| PubChem: | 8814 | |
| IUPAC: | 4-(2,4,4-trimethylpentan-2-yl)phenol | |
| Standard InChI: | InChI=1S/C14H22O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11/h6-9,15H,10H2,1-5H3 | |
| Standard InChI Key: | ISAVYTVYFVQUDY-UHFFFAOYSA-N | |
| SMILES: | CC(c1ccc(cc1)O)(CC(C)(C)C)C | |
Molecular propeties
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| AlogP: | 4.11 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 1 | |
| Molecular Weight: | 206.17 | |
| Topological polar surface area: | 20.2 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.571 | |
| Number of carbons: | 14 | |