| Phytochemical Name : 4-tert-Butylthiophenol |
| PCNDIDOT0891 |
| Pubchem CID : 75454 |
| Molecular formula: C10H14S |
| Canonical SMILES : CC(C)(C)C1=CC=C(C=C1)S |
Synonymes : 4-tert-Butylthiophenol|4-tert-Butylbenzenethiol|2396-68-1|p-tert-Butylthiophenol|p-tert-Butylbenzenethiol|Benzenethiol, p-tert-butyl-|Benzenethiol, 4-(1,1-dimethylethyl)-|p-t-Butylthiophenol|p-tert-Butylphenyl mercaptan|Benzenethiol, p-tert-butylthio-|4-(tert-butyl)thiophenol|4-(tert-Butyl)benzenethiol|NSC 26804|4-t-butylthiophenol|C10H14S|EINECS 219-255-6|4-tert-butyl-benzenethiol|NSC 57807|7ME8YQH3TG|BRN 0606476|4-tert-butylbenzene-1-thiol|AI3-26176|DTXSID9048196|4-(1,1-Dimethylethyl)Benzenethiol|NSC-26804|NSC-57807|NSC-229514|4-06-00-03316 (Beilstein Handbook Reference)|Benzenethiol,1-dimethylethyl)-|WLN: SHR DX1&1&1|4-tert-butylbenzenethiolate|p-t-butyl thiophenol|4-t-butyl-thiophenol|4-t-butylbenzenethiol|para-t-butylthiophenol|4-tert-butylbenzenthiol|4-Tertbutyl Thiophenol|p-tert-butyl-thiophenol|para-t-butyl-thiophenol|4-tert. butylthiophenol|4-tert.butyl-thiophenol|p-(tert-butyl)thiophenol|para-(t-butyl)thiophenol|UNII-7ME8YQH3TG|4-tert-butyl benzenethiol|4-tert. butyl-thiophenol|para-(t-butyl)-thiophenol|SCHEMBL67741|4-tert-Butylbenzenethiol, 97%|CHEMBL3186499|DTXCID4028171|AMY6904|EX-A6027|NSC26804|NSC57807|Tox21_303557|MFCD00022067|NSC229514|AKOS009031102|CS-W020815|PS-8737|s12031|NCGC00257390-01|LS-32188|CAS-2396-68-1|B0741|FT-0634245|EN300-21572|A817009|J-015294|J-516010|F0001-0819 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.550 |
| Log Po/w (XLOGP3) : 3.530 |
| Log Po/w (WLOGP) : 3.270 |
| Log Po/w (MLOGP) : 3.830 |
| Log Po/w (SILICOS-IT) : 3.260 |
| Consensus Log Po/w : 3.290 |