4-[2-(4-Aminophenyl)ethyl]benzenesulfonyl fluoride
Basic information
- CAS
21316-08-5- Standard SMILES
Nc1ccc(CCc2ccc(S(=O)(=O)F)cc2)cc1- InChIKey
UACOXIFJYLZLIF-UHFFFAOYSA-N- Molecular formula
- C14H14FNO2S
- Average molar mass
- 279.33 g/mol
- Monoisotopic mass
- 279.07292802
Names & identifiers
- Preferred name
- 4-[2-(4-Aminophenyl)ethyl]benzenesulfonyl fluoride
- IUPAC
- 4-[2-(4-aminophenyl)ethyl]benzenesulfonyl fluoride
Names & synonyms
21316-08-54-[2-(4-aminophenyl)ethyl]benzenesulfonyl fluorideNSC211132DTXSID60309107NSC-2111324-[2-(4-Aminophenyl)ethyl]benzene-1-sulfonyl fluoride
Database identifiers
- CAS
21316-08-5- PubChem CID
- 308997
- DTXSID
DTXSID60309107
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 363
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Compound notes
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