Basic information
- Standard SMILES
Cc1cscc1-c1ccccc1C=O- InChIKey
HNUQUHXBKFGTHR-UHFFFAOYSA-N- Molecular formula
- C12H10OS
- Average molar mass
- 202.27 g/mol
Names & identifiers
- Preferred name
- 2-(4-Methylthiophen-3-yl)benzaldehyde
- IUPAC
- 2-(4-methylthiophen-3-yl)benzaldehyde
Names & synonyms
1033804-69-12-(4-methylthiophen-3-yl)benzaldehydeSCHEMBL611134CHEMBL4454785HNUQUHXBKFGTHR-UHFFFAOYSA-N2-(4-Methyl-3-thienyl)benzaldehyde2-(4-methyl-thiophen-3-yl)benzaldehyde2-(4-methylthiophen-3-yl)-benzaldehydeDB-191663
Database identifiers
- PubChem CID
- 86621083
- ChEMBL
CHEMBL4454785
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 204
Related reactions
10 records
Compound notes
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