Benzenesulfonylfluoride, 4-[[4-[(2-chloro-4-nitrophenoxy)methyl]phenyl]methoxy]-
Basic information
- CAS
31185-39-4- Standard SMILES
O=[N+]([O-])c1ccc(OCc2ccc(COc3ccc(S(=O)(=O)F)cc3)cc2)c(Cl)c1- InChIKey
KVQFYRQDSSXKGX-UHFFFAOYSA-N- Molecular formula
- C20H15ClFNO6S
- Average molar mass
- 451.9 g/mol
- Monoisotopic mass
- 451.0292642
Names & identifiers
- Preferred name
- Benzenesulfonylfluoride, 4-[[4-[(2-chloro-4-nitrophenoxy)methyl]phenyl]methoxy]-
- IUPAC
- 4-[[4-[(2-chloro-4-nitrophenoxy)methyl]phenyl]methoxy]benzenesulfonyl fluoride
Names & synonyms
31185-39-44-((4-((2-Chloro-4-nitrophenoxy)methyl)benzyl)oxy)benzene-1-sulfonyl fluorideNSC212397starbld0019477Benzenesulfonylfluoride, 4-[[4-[(2-chloro-4-nitrophenoxy)methyl]phenyl]methoxy]-DTXSID30309614NSC-2123974-({4-[(2-Chloro-4-nitrophenoxy)methyl]phenyl}methoxy)benzene-1-sulfonyl fluoride
Database identifiers
- CAS
31185-39-4- PubChem CID
- 309936
- DTXSID
DTXSID30309614
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 653
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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