About (S)-phenyl(thiophen-3-yl)methanol
(S)-phenyl(thiophen-3-yl)methanol (PubChem CID 26792867) has the molecular formula C11H10OS
and a molecular weight of 190.27 g/mol. Its IUPAC name is (S)-phenyl(thiophen-3-yl)methanol.
Molecular Properties
| Compound Name | (S)-phenyl(thiophen-3-yl)methanol |
| PubChem CID | 26792867 |
| Molecular Formula | C11H10OS |
| Molecular Weight | 190.27 g/mol |
| Exact Mass | 190.05 |
| IUPAC Name | (S)-phenyl(thiophen-3-yl)methanol |
| SMILES | O[C@@H](c1ccccc1)c1ccsc1 |
| InChI | InChI=1S/C11H10OS/c12-11(10-6-7-13-8-10)9-4-2-1-3-5-9/h1-8,11-12H/t11-/m0/s1 |
| InChIKey | JHODTSHRBQFXAJ-NSHDSACASA-N |
| XLogP | 2.83 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 190.27 |
| LogP ≤ 5 | 2.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (S)-phenyl(thiophen-3-yl)methanol?
The IUPAC name of (S)-phenyl(thiophen-3-yl)methanol (CID 26792867) is (S)-phenyl(thiophen-3-yl)methanol.
What is the SMILES notation for (S)-phenyl(thiophen-3-yl)methanol?
The canonical SMILES for (S)-phenyl(thiophen-3-yl)methanol is O[C@@H](c1ccccc1)c1ccsc1.
What is the InChIKey of (S)-phenyl(thiophen-3-yl)methanol?
The InChIKey is JHODTSHRBQFXAJ-NSHDSACASA-N. The full InChI is InChI=1S/C11H10OS/c12-11(10-6-7-13-8-10)9-4-2-1-3-5-9/h1-8,11-12H/t11-/m0/s1.
What are the key properties of (S)-phenyl(thiophen-3-yl)methanol?
(S)-phenyl(thiophen-3-yl)methanol has a molecular weight of 190.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-phenyl(thiophen-3-yl)methanol is sourced from PubChem (CID 26792867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).