Basic information
- Standard SMILES
CCCCOc1ccc(S(=O)(=O)O)cc1- InChIKey
HCOADTVJXSJDJI-UHFFFAOYSA-N- Molecular formula
- C10H14O4S
- Average molar mass
- 230.28 g/mol
Names & identifiers
- Preferred name
- 4-Butoxy-benzenesulfonic acid
- IUPAC
- 4-butoxybenzenesulfonic acid
Names & synonyms
4-Butoxy-benzenesulfonic acidSCHEMBL4527668HCOADTVJXSJDJI-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 18767775
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 260
Related reactions
1 records
Compound notes
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