Benzenesulfonylfluoride, 4-[4-(3-nitrophenoxy)butoxy]-
Basic information
- CAS
31185-42-9- Standard SMILES
O=[N+]([O-])c1cccc(OCCCCOc2ccc(S(=O)(=O)F)cc2)c1- InChIKey
SNUUVWABKPKPMY-UHFFFAOYSA-N- Molecular formula
- C16H16FNO6S
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.06823657
Names & identifiers
- Preferred name
- Benzenesulfonylfluoride, 4-[4-(3-nitrophenoxy)butoxy]-
- IUPAC
- 4-[4-(3-nitrophenoxy)butoxy]benzenesulfonyl fluoride
Names & synonyms
31185-42-94-(4-(3-Nitrophenoxy)butoxy)benzene-1-sulfonyl fluoride4-[4-(3-Nitrophenoxy)butoxy]benzene-1-sulfonyl fluorideNSC212208Benzenesulfonylfluoride, 4-[4-(3-nitrophenoxy)butoxy]-starbld0019491DTXSID30309518NSC-212208
Database identifiers
- CAS
31185-42-9- PubChem CID
- 309770
- DTXSID
DTXSID30309518
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 510
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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