Benzenesulfonylfluoride, 4-[3-(2-chloro-5-nitrophenoxy)propoxy]-
Basic information
- CAS
31185-44-1- Standard SMILES
O=[N+]([O-])c1ccc(Cl)c(OCCCOc2ccc(S(=O)(=O)F)cc2)c1- InChIKey
MLOWPXDFEWKQGY-UHFFFAOYSA-N- Molecular formula
- C15H13ClFNO6S
- Average molar mass
- 389.8 g/mol
- Monoisotopic mass
- 389.0136142
Names & identifiers
- Preferred name
- Benzenesulfonylfluoride, 4-[3-(2-chloro-5-nitrophenoxy)propoxy]-
- IUPAC
- 4-[3-(2-chloro-5-nitrophenoxy)propoxy]benzenesulfonyl fluoride
Names & synonyms
31185-44-14-(3-(2-Chloro-5-nitrophenoxy)propoxy)benzene-1-sulfonyl fluoride4-[3-(2-Chloro-5-nitrophenoxy)propoxy]benzene-1-sulfonyl fluorideNSC212390starbld0019486Benzenesulfonylfluoride, 4-[3-(2-chloro-5-nitrophenoxy)propoxy]-DTXSID60309607NSC-212390
Database identifiers
- CAS
31185-44-1- PubChem CID
- 309929
- DTXSID
DTXSID60309607
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 529
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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