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Basic information
- Standard SMILES
CCOC(=O)C(C)=Cc1cc(F)c(Oc2ccc(S(=O)(=O)Cl)cc2)c(F)c1- InChIKey
FIMVUNWQMFEVMA-UHFFFAOYSA-N- Molecular formula
- C18H15ClF2O5S
- Average molar mass
- 416.8 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-[4-(4-chlorosulfonylphenoxy)-3,5-difluorophenyl]-2-methylprop-2-enoate
- IUPAC
- ethyl 3-[4-(4-chlorosulfonylphenoxy)-3,5-difluorophenyl]-2-methylprop-2-enoate
Database identifiers
- PubChem CID
- 91074155
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 629
Related reactions
2 records
Compound notes
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