Basic information
- CAS
62533-25-9- Standard SMILES
O=S(=O)(O)c1ccccc1-c1cccs1- InChIKey
PRBWKQFYRVJKFD-UHFFFAOYSA-N- Molecular formula
- C10H8O3S2
- Average molar mass
- 240.3 g/mol
- Monoisotopic mass
- 239.99148646
Names & identifiers
- Preferred name
- 2-(2-Thienyl)benzenesulfonic acid
- IUPAC
- 2-thiophen-2-ylbenzenesulfonic acid
Names & synonyms
2-(2-Thienyl)benzenesulfonic acid62533-25-9SCHEMBL28547668DTXSID4013005942-(Thiophen-2-yl)benzene-1-sulfonic acid
Database identifiers
- CAS
62533-25-9- PubChem CID
- 12371545
- DTXSID
DTXSID401300594
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 91 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 307
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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