Showing Metabocard for 3-formylthiophene (BASm0007652)
| Common Name | 3-formylthiophene |
|---|---|
| Description | Thiophen-3-carboxyaldehyde is a member of the class of compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring. Thiophen-3-carboxyaldehyde is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Thiophen-3-carboxyaldehyde can be found in kohlrabi, which makes thiophen-3-carboxyaldehyde a potential biomarker for the consumption of this food product. |
| Structure | |
| Molecular Formula | C5H4OS |
| Average Mass | 112.15000 |
| Monoisotopic Mass | 111.99829 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | O=Cc1ccsc1 |
| InChI Identifier | InChI=1S/C5H4OS/c6-3-5-1-2-7-4-5/h1-4H |
| InChI Key | RBIGKSZIQCTIJF-UHFFFAOYSA-N |
| CHEBI ID | CHEBI:87611 |
| HMDB ID | HMDB0302373 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |