Basic information
- Standard SMILES
O=C(O)c1cc(S(=O)O)c(Cl)cc1Cl- InChIKey
RWQFBWJWNXASDU-UHFFFAOYSA-N- Molecular formula
- C7H4Cl2O4S
- Average molar mass
- 255.07 g/mol
Names & identifiers
- Preferred name
- 2,4-Dichloro-5-carboxybenzenesulfinic acid
- IUPAC
- 2,4-dichloro-5-sulfinobenzoic acid
Names & synonyms
2,4-dichloro-5-carboxybenzenesulfinic acidSCHEMBL11819327RWQFBWJWNXASDU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21543946
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 93.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 260
Related reactions
4 records
Compound notes
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