Basic information
- Standard SMILES
O=C(O)CS(=O)(=O)Cc1ccc(Cl)cc1Cl- InChIKey
IGHOQZIXSOUKCP-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O4S
- Average molar mass
- 283.13 g/mol
Names & identifiers
- Preferred name
- 2-(2,4-Dichlorobenzylsulfonyl)acetic acid
- IUPAC
- 2-[(2,4-dichlorophenyl)methylsulfonyl]acetic acid
Names & synonyms
NSC190481SCHEMBL829874IGHOQZIXSOUKCP-UHFFFAOYSA-NAKOS000186515NSC-1904812-(2,4-dichlorobenzylsulfonyl)acetic acid
Database identifiers
- PubChem CID
- 302764
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 349
Related reactions
1 records
Compound notes
Loading…