Basic information
- CAS
3233-63-4- Standard SMILES
O=S(=O)(O)Oc1ccc(Cl)cc1Cl- InChIKey
XEBCTJAOHUUGHB-UHFFFAOYSA-N- Molecular formula
- C6H4Cl2O4S
- Average molar mass
- 243.06 g/mol
- Monoisotopic mass
- 241.9207352
Names & identifiers
- Preferred name
- 2,4-Dichlorophenyl sulfate
- IUPAC
- (2,4-dichlorophenyl) hydrogen sulfate
Names & synonyms
2,4-Dichlorophenyl sulfateSCHEMBL1062499DTXSID4010259703233-63-4
Database identifiers
- CAS
3233-63-4- PubChem CID
- 9837697
- DTXSID
DTXSID401025970
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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